SCHEMBL371368

SCHEMBL371368

Cc1cc(CCc2nn(-c3cnn(C)c3)ccc2=O)ccc1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 1/20 0.37
MET P08581 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RARB P10826 1/20 0.35
MCHR1 Q99705 11/20 0.35
NR1H4 Q96RI1 1/20 0.34
GRM2 Q14416 1/20 0.33
AGTR1 P30556 1/20 0.33
AGTR2 P50052 1/20 0.33
MAP4K4 O95819 1/20 0.33

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
SCHEMBL12503525 0.82 EP300 (0.38) METMEN1KMT2A
SCHEMBL359630 0.80 MET (0.42) METMEN1KMT2A
SCHEMBL359649 0.79 GFER (0.33) METKMT2AMAP4K4
SCHEMBL369021 0.79 MET (0.39) METGRM2
SCHEMBL14915939 0.78 KDM5A (0.33) MET
SCHEMBL2343070 0.78 ALDH1A1 (0.41) MET
SCHEMBL14916044 0.78 MEN1 (0.36) METMEN1KMT2AGRM2
SCHEMBL10283525 0.77 RAB9A (0.37) MEN1KMT2A
SCHEMBL164181 0.76 MET (0.53) MET
SCHEMBL173996 0.75 CYP2C9 (0.37) RIPK2MEN1KMT2AMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593107-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2013-05-22 EP disclosed
WO-2012009194-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-01-19 WO disclosed