SCHEMBL2732237

SCHEMBL2732237

NC(=O)c1c(-n2cccn2)ccnc1Nc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.42
SYK P43405 9/20 0.40
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
AHR P35869 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SLC40A1 Q9NP59 1/20 0.37
AURKA O14965 2/20 0.37
MAPK8 P45983 1/20 0.37
LMNA P02545 1/20 0.36
SRC P12931 1/20 0.36
CXCR4 P61073 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL2732234 0.79 KDM4E (0.44) SYKALDH1A1AURKAMAPK8LMNA
SCHEMBL21438811 0.76 ALDH1A1 (0.40) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL2732238 0.72 SYK (0.45) SYKMAPTNPC1AHRRAB9A
SCHEMBL2732235 0.72 CSF1R (0.44) SYKJAK2
SCHEMBL21465577 0.69 HCRTR1 (0.37) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL21439541 0.69 LMNA (0.46) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL3544059 0.68 NPC1 (0.49) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL15272776 0.68 GAA (0.57) SYKMAPTALDH1A1GAAKDM4E
SCHEMBL17443085 0.68 LMNA (0.40) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL479805 0.66 DHODH (0.76) DHODHMAPTALDH1A1MEN1GAA

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