SCHEMBL2713348

SCHEMBL2713348

C[C@H](CCN)Nc1nc(Nc2ccc3ncccc3c2)c(C(N)=O)cc1F

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 11/20 0.55
MET P08581 1/20 0.43
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 2/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 2/20 0.40
AHR P35869 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TNIK Q9UKE5 1/20 0.40
EGFR P00533 1/20 0.39

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
SCHEMBL2713351 1.00 SYK (0.55) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL14908656 0.94 SYK (0.56) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL14908655 0.94 SYK (0.56) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL14929940 0.92 SYK (0.61) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL14910085 0.90 SYK (0.54) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL2715559 0.89 SYK (0.56) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL14909554 0.88 SYK (0.54) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL14909553 0.88 SYK (0.54) SYKMETALDH1A1CYP1A2CYP3A4
SCHEMBL5026970 0.88 SYK (0.58) SYKMETNPC1MAPTPOLB
SCHEMBL9108358 0.88 SYK (0.58) SYKMETNPC1MAPTPOLB

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 disclosed
WO-2012061418-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed