SCHEMBL4045988

SCHEMBL4045988

Cc1ccc2c(=O)[nH]cnn12

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 6/20 0.39
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
BRD4 O60885 2/20 0.38
ALDH1A1 P00352 1/20 0.33
CHEK1 O14757 1/20 0.33
PIM1 P11309 1/20 0.33
RPS6KA3 P51812 1/20 0.33
PDE4B Q07343 1/20 0.31
PDE3A Q14432 1/20 0.31
EGFR P00533 1/20 0.31
KDR P35968 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL15740083 0.78 PARP1 (0.33) PARP1BRD4ALDH1A1
SCHEMBL15908749 0.77 CHEK1 (0.33) BRD4CHEK1PIM1
SCHEMBL22349705 0.77 HPGD (0.35) PARP1TNKSTNKS2BRD4ALDH1A1
SCHEMBL12463601 0.76
SCHEMBL20755597 0.73 NR1H2 (0.33) BRD4
SCHEMBL358102 0.72 NR1H2 (0.45) ALDH1A1
SCHEMBL12395219 0.72 PARP1 (0.36) PARP1
SCHEMBL20756064 0.70 NR1H2 (0.31) BRD4
SCHEMBL15908746 0.68 PARP1 (0.43) PARP1BRD4CHEK1PIM1RPS6KA3
SCHEMBL18520816 0.68 ALDH1A1 (0.42) PARP1BRD4ALDH1A1CHEK1PIM1

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 46 patents — showing the first 20. 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-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-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-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-7244733-B2 Pyrrolotriazine inhibitors of kinases BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-17 US disclosed
US-7112675-B2 Pyrrolotriazine inhibitors of kinases BRISTOL-MYERS SQUIBB COMPANY (US) 2006-09-26 US disclosed
US-20060128709-A1 Pyrrolotriazine inhibitors of kinases BRISTOL-MYERS SQUIBB COMPANY 2006-06-15 US disclosed
EP-1669071-A1 Pyrrolotriazine inhibitors of kinases BRISTOL-MYERS SQUIBB COMPANY (US) 2006-06-14 EP disclosed
EP-1183033-B1 PYRROLOTRIAZINE INHIBITORS OF KINASES BRISTOL MYERS SQUIBB CO (US) 2006-03-01 EP disclosed
US-20060004007-A1 Pyrrolotriazine inhibitors of kinases BRISTOL-MYERS SQUIBB COMPANY 2006-01-05 US disclosed
US-6982265-B1 Pyrrolotriazine inhibitors of kinases BRISTOL MYERS SQUIBB COMPANY (US) 2006-01-03 US disclosed
EP-1183033-A4 PYRROLOTRIAZINE INHIBITORS OF KINASES BRISTOL MYERS SQUIBB CO (US) 2002-07-17 EP disclosed
EP-1183033-A1 PYRROLOTRIAZINE INHIBITORS OF KINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2002-03-06 EP disclosed
WO-2000071129-A1 PYRROLOTRIAZINE INHIBITORS OF KINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2000-11-30 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 (7 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-10981915-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 PARP1 1141/4885TNKS 1059/4885TNKS2 1048/4885
US-20190308980-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 PARP1 1141/4885TNKS 1059/4885TNKS2 1048/4885
US-20220033403-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 PARP1 1141/4885TNKS 1059/4885TNKS2 1048/4885
US-20060128709-A1 Pyrrolotriazine inhibitors of kinases FGFR1, FGFR2, ERBB2 PARP1 677/4885TNKS 864/4885TNKS2 500/4885
US-20060004007-A1 Pyrrolotriazine inhibitors of kinases FGFR1, FGFR2, ERBB2 PARP1 677/4885TNKS 864/4885TNKS2 500/4885
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 PARP1 1141/4885TNKS 1059/4885TNKS2 1048/4885
US-10351571-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 PARP1 1141/4885TNKS 1059/4885TNKS2 1048/4885

“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.