SCHEMBL2713764

SCHEMBL2713764

NC(=O)c1c(F)ccnc1Nc1ccc2ncccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.51
POLB P06746 2/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SYK P43405 5/20 0.49
EGFR P00533 1/20 0.48
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.47
GRM4 Q14833 1/20 0.46
PABPC1 P11940 1/20 0.46
MAPK8 P45983 1/20 0.44
RAB9A P51151 5/20 0.44
TNIK Q9UKE5 1/20 0.43
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42

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
SCHEMBL2713518 0.86 NPSR1 (0.47) NPC1POLBMAPTALDH1A1TSHR
SCHEMBL2716637 0.81 NPC1 (0.63) NPC1POLBMAPTMEN1KMT2A
SCHEMBL13074772 0.79 SYK (0.54) NPC1POLBMAPTMEN1KMT2A
SCHEMBL2713766 0.79 SYK (0.56) NPC1POLBMAPTMEN1KMT2A
SCHEMBL14923853 0.78 SYK (0.56) NPC1POLBMAPTMEN1KMT2A
SCHEMBL2714064 0.78 AURKA (0.54) MAPTMEN1KMT2AEGFRLMNA
SCHEMBL14910350 0.77 SYK (0.55) NPC1POLBMAPTMEN1KMT2A
SCHEMBL2713762 0.77 NPC1 (0.55) NPC1POLBMAPTMEN1KMT2A
SCHEMBL14909181 0.75 SYK (0.52) NPC1POLBMAPTMEN1KMT2A
SCHEMBL14908667 0.75 SYK (0.52) NPC1POLBMAPTMEN1KMT2A

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-2635556-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 EP claimed
WO-2012061418-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO claimed