SCHEMBL396158

SCHEMBL396158

CCN(CC)CCNC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3cc(NC(=O)Nc4cc(NC(=O)c5ccccc5)ccc4C)ccc32)c1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 7/20 0.69
KDR P35968 9/20 0.65
PRKAA1 Q13131 7/20 0.65
PRKAA2 P54646 5/20 0.65
PDGFRB P09619 5/20 0.65
FGFR1 P11362 4/20 0.65
FLT3 P36888 5/20 0.62
AURKB Q96GD4 3/20 0.62
KIT P10721 3/20 0.60
EGFR P00533 3/20 0.60
NEK2 P51955 2/20 0.60
MELK Q14680 2/20 0.60
FLT4 P35916 3/20 0.58
GRK5 P34947 3/20 0.58
PLK4 O00444 2/20 0.58
DCLK1 O15075 2/20 0.58
PDPK1 O15530 2/20 0.58
DAPK3 O43293 2/20 0.58
ROCK2 O75116 2/20 0.58
RPS6KA5 O75582 2/20 0.58

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
SCHEMBL10091875 1.00 CSF1R (0.69) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL396403 0.94 KDR (0.66) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL393969 0.94 KDR (0.66) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL10091903 0.94 KDR (0.66) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL10091882 0.94 KDR (0.66) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL10091886 0.93 FLT3 (0.61) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL394109 0.93 FLT3 (0.61) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL394524 0.93 CSF1R (0.73) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL10091889 0.93 CSF1R (0.73) CSF1RKDRPRKAA1PRKAA2PDGFRB
SCHEMBL10091843 0.93 KDR (0.75) CSF1RKDRPRKAA1PRKAA2PDGFRB

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
US-8101608-B2 3-(4-Methyl-imidazol-1-yl)-N-{3-[2-oxo-3-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-1H-indol-6-ylamino]-phenyl}-5-trifluoromethyl-benzamide; including benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC, a Delware Limited Corporation (BM) 2012-01-24 US claimed
US-8101608-B2 3-(4-Methyl-imidazol-1-yl)-N-{3-[2-oxo-3-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-1H-indol-6-ylamino]-phenyl}-5-trifluoromethyl-benzamide; including benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC, a Delware Limited Corporation (BM) 2012-01-24 US disclosed