SCHEMBL3010245

SCHEMBL3010245

CCCCOC(=O)NN1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.52
MAPT P10636 4/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
TP53 P04637 2/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
KMT2A Q03164 1/20 0.52
RELA Q04206 1/20 0.52
ALDH1A1 P00352 4/20 0.46
EPHX1 P07099 1/20 0.44
ACHE P22303 8/20 0.43
LMNA P02545 3/20 0.43
THRB P10828 2/20 0.43
CYP1A2 P05177 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL1383077 0.98 SMN1; SMN2 (0.50) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL7841197 0.95 SMN1; SMN2 (0.47) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL8590406 0.93 EPHX1 (0.54) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL8589909 0.92 EPHX1 (0.56) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL7750794 0.85 EPHX1 (0.46) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL7194159 0.84 EPHX1 (0.59) SMN1; SMN2EPHX1ACHEMAPK1NPSR1
SCHEMBL28783627 0.83 GNAI3 (0.55) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL2885378 0.82 LIPE (0.44) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL6381523 0.82 SMN1; SMN2 (0.40) SMN1; SMN2MAPTNPC1RAB9ATP53
SCHEMBL7009651 0.81 EPHX1 (0.40) SMN1; SMN2MAPTNPC1RAB9ATP53

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101899058-B Method for preparing thiazolopyrimidine compound, thiazolopyrimidine compound and application thereof FOURTH MILITARY MEDICAL UNIV 2012-05-23 CN claimed
US-11739070-B2 C5A receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2023-08-29 US disclosed
CN-101899058-B Method for preparing thiazolopyrimidine compound, thiazolopyrimidine compound and application thereof FOURTH MILITARY MEDICAL UNIV 2012-05-23 CN disclosed
US-20100204187-A1 Purine Derivatives PALAU PHARMA, S.A. (ES) 2010-08-12 US disclosed
EP-2044077-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES Glaxo Group Limited (GB) 2009-04-08 EP disclosed
EP-1989185-A1 THERAPEUTIC COMPOUNDS Helicon Therapeutics, Inc. (US) 2008-11-12 EP disclosed
WO-2008009700-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LIMITED (GB) 2008-01-24 WO disclosed
WO-2007100851-A1 THERAPEUTIC COMPOUNDS HELICON THERAPEUTICS, INC. (US) 2007-09-07 WO disclosed
EP-1709049-A1 BICYCLIC IMIDAZOLE COMPOUNDS, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2006-10-11 EP disclosed
EP-1565468-A1 NOVEL XANTHIN DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2005-08-24 EP disclosed
WO-2005063750-A1 BICYCLIC IMIDAZOLE COMPOUNDS, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-07-14 WO disclosed
US-20040242888-A1 Process for producing 1-alkoxycarbonyl nitrogenous saturated heterocyclic derivative TORAY FINE CHEMICALS CO., LTD., A CORPORATION OF JAPAN (JP) 2004-12-02 US disclosed
EP-1460061-A1 PROCESS FOR PRODUCING 1-ALKOXYCARBONYL NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE Toray Fine Chemicals Co., Ltd. (JP) 2004-09-22 EP disclosed
WO-2004046148-A1 NOVEL XANTHIN DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-06-03 WO disclosed
EP-1102762-A2 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER INC. (US) 2001-05-30 EP disclosed
WO-2000008013-A2 2-SUBSTITUTED-1-PIPERIDYL BENZIMIDAZOLE COMPOUNDS AS ORL1-RECEPTOR AGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2000-02-17 WO disclosed
EP-0719264-B1 IMIDAZOLONE AND OXAZOLONE DERIVATIVES AS DOPAMINE ANTAGONISTS MERCK SHARP & DOHME (GB) 1997-12-29 EP disclosed
US-5698573-A Imidazolone and oxazolone derivatives as dopamine antagonists MERCK, SHARP & DOHME, LTD. (GB) 1997-12-16 US 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 (3 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-20040242888-A1 Process for producing 1-alkoxycarbonyl nitrogenous saturated heterocyclic derivative DAO, DDO, ODC1 SMN1; SMN2 2086/4885MAPT 1829/4885NPC1 830/4885
US-20100204187-A1 Purine Derivatives JAK3, JAK1, JAK2 SMN1; SMN2 3941/4885MAPT 4689/4885NPC1 3856/4885
US-11739070-B2 C5A receptor modulators C5AR1, C3AR1, C5AR2 SMN1; SMN2 4661/4885MAPT 4529/4885NPC1 2424/4885

“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.