SCHEMBL20748504

SCHEMBL20748504

Nc1cccc(-c2ccnc(-c3ccc[nH]3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.49
KDR P35968 2/20 0.46
MAP4K4 O95819 3/20 0.44
ASIC3 Q9UHC3 2/20 0.44
METAP2 P50579 1/20 0.43
MEN1 O00255 2/20 0.42
PSIP1 O75475 1/20 0.42
AXL P30530 1/20 0.42
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
MAOA P21397 1/20 0.42
NTRK1 P04629 1/20 0.41
PIK3CA P42336 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL1460341 0.86 KDM4C (0.50) KDM4CKDRMAP4K4ASIC3NTRK1
SCHEMBL20748703 0.78 KDR (0.56) KDM4CKDRNTRK1ALDH1A1MAPT
SCHEMBL6521352 0.78 KDR (0.51) KDM4CKDRMEN1ALDH1A1MAPT
SCHEMBL30469333 0.78 MAOA (0.50) MAP4K4METAP2MEN1PSIP1AXL
SCHEMBL16236283 0.78 MAOA (0.50) MAP4K4METAP2MEN1PSIP1AXL
SCHEMBL28511258 0.77 MAOA (0.55) MAP4K4METAP2MEN1PSIP1AXL
SCHEMBL10179472 0.72 KDR (0.61) KDM4CKDRMEN1NPC1RAB9A
SCHEMBL28687161 0.72 ASIC3 (0.54) MAP4K4ASIC3MEN1PSIP1AXL
SCHEMBL30880192 0.72 ASIC3 (0.54) MAP4K4ASIC3MEN1PSIP1AXL
SCHEMBL2686693 0.71 MAP4K4 (0.58) MAP4K4ASIC3MEN1PSIP1AXL

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-2473501-B1 COMPOUNDS AS TYROSINE KINASE MODULATORS ALLERGAN INC (US) 2019-02-20 EP disclosed