SCHEMBL10285385

SCHEMBL10285385

COc1ccc(Nc2cc(N)c(C(N)=O)cn2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 3/20 0.56
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
SYK P43405 1/20 0.49
RAB9A P51151 5/20 0.48
NPC1 O15118 3/20 0.48
EGFR P00533 1/20 0.47
ERBB3 P21860 1/20 0.47
GAA P10253 4/20 0.47
GFER P55789 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MAPK9 P45984 1/20 0.46
MAPK10 P53779 1/20 0.46
GRM5 P41594 1/20 0.46
IRAK4 Q9NWZ3 2/20 0.45
JAK2 O60674 2/20 0.45
JAK1 P23458 2/20 0.45
TYK2 P29597 2/20 0.45
JAK3 P52333 1/20 0.45
MAPT P10636 2/20 0.45

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
SCHEMBL2693804 0.87 CSF1R (0.56) CSF1RMEN1KMT2ASYKMAPK9
SCHEMBL2694558 0.83 AKR1C3 (0.55) CSF1RMEN1KMT2ASYKIRAK4
SCHEMBL2696618 0.80 CSF1R (0.49) CSF1RMEN1KMT2ASYKRAB9A
SCHEMBL2696622 0.78 JAK3 (0.59) CSF1RIRAK4JAK2JAK1TYK2
SCHEMBL2694919 0.78 CSF1R (0.47) CSF1RMEN1KMT2ASYKRAB9A
SCHEMBL2479684 0.78 JAK3 (0.79) CSF1RMEN1KMT2AIRAK4JAK2
SCHEMBL2694923 0.77 JAK3 (0.61) CSF1RMEN1KMT2AIRAK4JAK2
SCHEMBL17452163 0.77 IRAK4 (0.62) CSF1RMEN1KMT2ASYKRAB9A
SCHEMBL2696458 0.77 JAK3 (0.52) CSF1RSYKIRAK4JAK2JAK1
SCHEMBL2694880 0.76 JAK3 (0.56) CSF1RMAPK10IRAK4JAK2JAK1

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
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed