SCHEMBL396229

SCHEMBL396229

CCN(CC)CCNC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3cc(Nc4cccc(NC(=O)c5cccc(C(F)(F)F)c5)c4)ccc32)c1C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK2 Q16620 4/20 0.66
CSF1R P07333 6/20 0.65
KDR P35968 8/20 0.63
PRKAA1 Q13131 7/20 0.63
PRKAA2 P54646 5/20 0.63
PDGFRB P09619 5/20 0.60
FGFR1 P11362 3/20 0.60
NTRK1 P04629 5/20 0.60
FLT3 P36888 4/20 0.60
AURKB Q96GD4 3/20 0.59
NTRK3 Q16288 3/20 0.58
EGFR P00533 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
RPS6KA4 O75676 2/20 0.58
MAP4K4 O95819 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
SCHEMBL10091898 1.00 NTRK2 (0.66) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL395944 0.97 CSF1R (0.69) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL10091859 0.97 CSF1R (0.69) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL10091905 0.94 CSF1R (0.62) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL397867 0.94 CSF1R (0.62) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL10091899 0.93 NTRK2 (0.73) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL397946 0.93 NTRK2 (0.73) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL10091894 0.91 KDR (0.69) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL396849 0.91 KDR (0.69) NTRK2CSF1RKDRPRKAA1PRKAA2
SCHEMBL10091852 0.90 NTRK2 (0.67) NTRK2CSF1RKDRPRKAA1PRKAA2

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 3 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-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors BMX, FRK, PTK2B NTRK2 235/4885CSF1R 796/4885KDR 204/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.