SCHEMBL4488098

SCHEMBL4488098

CCc1c(-c2c(C)noc2C)[nH]c(C=O)c1C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.44
NPSR1 Q6W5P4 3/20 0.44
POLB P06746 3/20 0.44
MAPT P10636 1/20 0.44
STAT1 P42224 1/20 0.44
ATM Q13315 1/20 0.44
FTO Q9C0B1 1/20 0.44
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
TSHR P16473 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
MAPK1 P28482 1/20 0.40
KCNH2 Q12809 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL4494571 0.81 RAB9A (0.50) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4485201 0.80 RAB9A (0.47) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4502843 0.80 RAB9A (0.49) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL13919332 0.79 RAB9A (0.46) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4485662 0.79 GCGR (0.48) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4481903 0.78 RAB9A (0.45) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4494081 0.77 RAB9A (0.47) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4484441 0.77 RAB9A (0.46) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4490038 0.76 NPC1 (0.49) RAB9ANPSR1POLBMAPTSTAT1
SCHEMBL4482565 0.76 RAB9A (0.45) RAB9ANPSR1POLBMAPTSTAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US claimed
EP-1651599-A4 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2008-09-24 EP claimed
US-20060189577-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2006-08-24 US claimed
EP-1651599-A1 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2006-05-03 EP claimed
WO-2005009957-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2005-02-03 WO claimed
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US disclosed
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US disclosed
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US disclosed
EP-1651599-A4 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2008-09-24 EP disclosed
US-20060189577-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2006-08-24 US disclosed
EP-1651599-A1 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2006-05-03 EP disclosed
WO-2005009957-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2005-02-03 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 (1 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-20060189577-A1 Tyrosine kinase inhibitors ABL1, RET, ERBB2 RAB9A 2642/4885NPSR1 376/4885POLB 4170/4885

“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.