SCHEMBL1753182

SCHEMBL1753182

CCOC(=O)c1[nH]nc(-c2ccccc2)c1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.60
KDM4E B2RXH2 4/20 0.55
RAB9A P51151 5/20 0.55
ALDH1A1 P00352 6/20 0.54
HSD17B10 Q99714 4/20 0.54
HPGD P15428 3/20 0.53
ADORA3 P0DMS8 3/20 0.50
AURKA O14965 1/20 0.50
MAPK10 P53779 1/20 0.50
RIPK1 Q13546 1/20 0.50
JAK2 O60674 2/20 0.49
JAK3 P52333 2/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 3/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 2/20 0.48
MAPK1 P28482 1/20 0.48
ATM Q13315 1/20 0.48
POLB P06746 1/20 0.48
NPC1 O15118 3/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27321802 0.87 RAB9A (0.63) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL10172532 0.86 HPGDS (0.60) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL3493236 0.86 HPGDS (0.60) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL7001551 0.85 NPC1 (0.51) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL19625068 0.85 KDM4E (0.55) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL17966240 0.85 SMN1; SMN2 (0.60) KDM4ERAB9AALDH1A1HSD17B10HPGD
SCHEMBL5330670 0.82 HPGDS (0.56) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL1969117 0.82 HPGDS (0.59) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL7001042 0.81 HSD17B10 (0.50) HPGDSKDM4ERAB9AALDH1A1HSD17B10
SCHEMBL648130 0.81 HPGDS (0.55) HPGDSKDM4ERAB9AALDH1A1HSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210323978-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-21 US disclosed
US-20210323978-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-21 US disclosed
US-10927130-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors VALO EARLY DISCOVERY, INC. (US) 2021-02-23 US disclosed
US-10377773-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2019-08-13 US disclosed
US-10377773-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2019-08-13 US disclosed
US-20180346485-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2018-12-06 US disclosed
US-9938300-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2018-04-10 US disclosed
US-9938300-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2018-04-10 US disclosed
WO-2016126935-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2016-08-11 WO disclosed
US-20160229872-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-08-11 US disclosed
US-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity IRM LLC (BM) 2009-10-01 US disclosed
US-20090247517-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2009-10-01 US disclosed
EP-1999132-A1 AZOLOPYRIMIDINES AS INHIBITORS OF CANNABINOID 1 ACTIVITY IRM, LLC (BM) 2008-12-10 EP disclosed
WO-2008107418-A1 FUSED PYRIMIDINONE COMPOUNDS AS MGLUR LIGANDS NOVARTIS AG (CH) 2008-09-12 WO disclosed
WO-2007120454-A1 AZOLOPYRIMIDINES AS INHIBITORS OF CANNABINOID 1 ACTIVITY IRM LLC (BM) 2007-10-25 WO disclosed
EP-1814885-A2 NOVEL BICYCLIC HETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM Reddy US Therapeutics, Inc. (US) 2007-08-08 EP disclosed
EP-1807429-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM, LLC (BM) 2007-07-18 EP disclosed
WO-2006073610-A2 NOVEL BICYCLIC HETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM REDDY US THERAPEUTICS, INC. (US) 2006-07-13 WO disclosed
US-20060128729-A1 Novel bicyclic heterocyclic compounds, process for their preparation and compositions containing them DR. REDDY'S LABORATORIES LTD. (IN) 2006-06-15 US disclosed
WO-2006047516-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2006-05-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity CNR1, CNR2, ITPR2 HPGDS 669/4885KDM4E 1045/4885RAB9A 3237/4885
US-10377773-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors USP7, USP3, SENP7 HPGDS 2384/4885KDM4E 1778/4885RAB9A 1946/4885
US-20180346485-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, USP3, SENP7 HPGDS 2384/4885KDM4E 1778/4885RAB9A 1946/4885
US-10927130-B2 Isothiazolopyrimidinones, pyrazolopyrimidinones, and pyrrolopyrimidinones as ubiquitin-specific protease 7 inhibitors USP7, USP3, SENP7 HPGDS 2384/4885KDM4E 1778/4885RAB9A 1946/4885
US-20210323978-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, USP3, SENP7 HPGDS 2384/4885KDM4E 1778/4885RAB9A 1946/4885
US-20060128729-A1 Novel bicyclic heterocyclic compounds, process for their preparation and compositions containing them HPSE, ENGASE, UGCG HPGDS 89/4885KDM4E 2836/4885RAB9A 3524/4885
US-20160229872-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, USP3, SENP7 HPGDS 2384/4885KDM4E 1778/4885RAB9A 1946/4885
US-20090247517-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH HPGDS 1022/4885KDM4E 1763/4885RAB9A 902/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.