SCHEMBL2365235

SCHEMBL2365235

Cn1ccc(-n2ccc(=O)c(Cc3cccc(NC(=O)O)c3)n2)n1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
PARP1 P09874 12/20 0.39
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
POLB P06746 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
TP53 P04637 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL12517652 0.89 PARP1 (0.52) LMNAPARP1NPC1RAB9ASMN1; SMN2
SCHEMBL12517920 0.86 HPGD (0.44) LMNAPARP1NPC1RAB9ASMN1; SMN2
SCHEMBL13449281 0.85 PARP1 (0.41) LMNAPARP1NPC1RAB9ASMN1; SMN2
SCHEMBL13274891 0.84 ELOVL1 (0.45) LMNAPARP1NPC1RAB9APOLB
SCHEMBL165695 0.83 PARP1 (0.40) LMNAPARP1NPC1RAB9APOLB
SCHEMBL13275323 0.81 PARP1 (0.41) LMNAPARP1SMN1; SMN2MEN1KMT2A
SCHEMBL13274775 0.80 PARP1 (0.39) LMNAPARP1NPC1RAB9APOLB
SCHEMBL13505233 0.80 MEN1 (0.41) LMNAPARP1NPC1RAB9APOLB
SCHEMBL2362647 0.80 PARP1 (0.42) LMNAPARP1MEN1KMT2A
SCHEMBL13505160 0.80 FPR1 (0.46) PARP1NPC1RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP claimed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US claimed
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 LMNA 4501/4885PARP1 2307/4885NPC1 3559/4885

“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.