SCHEMBL31746914

SCHEMBL31746914

Cc1n[nH]c2cc(Nc3cccc4ccn(CC(=O)N[C@@H](C)C(F)(F)F)c(=O)c34)ccc12

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.37
GRM4 Q14833 1/20 0.36
ELANE P08246 14/20 0.36
PSMB1 P20618 1/20 0.35
PSMB5 P28074 1/20 0.35
MEN1 O00255 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPK8 P45983 1/20 0.33
MAPK10 P53779 1/20 0.33
MAPK14 Q16539 1/20 0.33
ALK Q9UM73 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
SCHEMBL25073846 1.00 GRIN2B (0.37) GRIN2BGRM4ELANEPSMB1PSMB5
SCHEMBL25073889 0.88 KMT2A (0.37) GRM4MEN1RAB9AKMT2A
SCHEMBL31746887 0.88 KMT2A (0.37) GRM4MEN1RAB9AKMT2A
SCHEMBL31746899 0.86 MAPK8 (0.38) GRM4KMT2AMAPK8MAPK10MAPK14
SCHEMBL25073905 0.86 MAPK8 (0.38) GRM4KMT2AMAPK8MAPK10MAPK14
SCHEMBL25073769 0.85 KDR (0.45) KMT2A
SCHEMBL31746908 0.85 KDR (0.45) KMT2A
SCHEMBL31162661 0.82 MAPT (0.43) MEN1RAB9AKMT2A
SCHEMBL25073807 0.82 NLRP3 (0.41) MEN1RAB9AKMT2A
SCHEMBL31746882 0.82 NLRP3 (0.41) MEN1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4387963-B1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 REDX PHARMA LTD (GB) 2025-12-24 EP disclosed