SCHEMBL17868441

SCHEMBL17868441

O=c1[nH]cnn2c(Br)ncc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.34
CHEK1 O14757 1/20 0.33
PIM1 P11309 1/20 0.33
AKT1 P31749 1/20 0.33
FLT3 P36888 1/20 0.33
PIM3 Q86V86 1/20 0.33
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
ADORA2A P29274 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
XDH P47989 1/20 0.32
RAB9A P51151 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4A O75164 1/20 0.30
KDM4B O94953 1/20 0.30
KDM5C P41229 1/20 0.30
KDM4C Q9H3R0 1/20 0.30

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
SCHEMBL13218216 0.81 ALDH1A1 (0.36) ALDH1A1LMNATSHRADORA2ASLC6A4
SCHEMBL15908749 0.73 CHEK1 (0.33) HPGDCHEK1PIM1AKT1FLT3
SCHEMBL594884 0.73 DYRK1A (0.43) ALDH1A1HPGDCHEK1LMNATSHR
SCHEMBL398420 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL22547338 0.72 ALDH1A1 (0.39) ALDH1A1HPGDCHEK1PIM1AKT1
SCHEMBL398419 0.72 PDE9A (0.37) FLT3
SCHEMBL594883 0.71 AURKA (0.41) FLT3
SCHEMBL15264769 0.70 BRD4 (0.42) ALDH1A1HPGD
SCHEMBL15141923 0.69 PDE9A (0.49)
SCHEMBL18168816 0.68 BRD4 (0.32) HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-10-24 US disclosed
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-10-24 US disclosed
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-10-24 US disclosed
US-20220033403-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2022-02-03 US disclosed
US-10981915-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO EARLY DISCOVERY, INC. (US) 2021-04-20 US disclosed
US-20190308980-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2019-10-10 US disclosed
US-10351571-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2019-07-16 US disclosed
US-20180339991-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2018-11-29 US disclosed
US-10000495-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2018-06-19 US disclosed
US-10000495-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2018-06-19 US disclosed
WO-2016109480-A1 PYRROLOTRIAZINONE AND IMIDAZOTRIAZINONE DERIVATIVES AS UBIQUITIN-SPECIFIC PROTEASE 7 (USP7) INHIBITORS FOR THE TREATMENT OF CANCER FORMA THERAPEUTICS, INC. (US) 2016-07-07 WO disclosed
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-06-30 US disclosed
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-06-30 US disclosed
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-06-30 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 (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-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-10981915-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-20190308980-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-20220033403-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-20180339991-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-10351571-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885
US-10000495-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 ALDH1A1 2470/4885HPGD 3174/4885CHEK1 2351/4885

“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.