SCHEMBL396252

SCHEMBL396252

Cc1ccc(NC(=O)c2cc(N3CCN(C)CC3)cc(C(F)(F)F)c2)cc1Nc1ccc2c(c1)NC(=O)C2=Cc1cc(C#N)c[nH]1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTRK2 Q16620 9/20 0.85
▸ NTRK1 P04629 12/20 0.67
▸ NTRK3 Q16288 3/20 0.57
▸ SRC P12931 3/20 0.51
▸ RAF1 P04049 2/20 0.51
▸ AURKA O14965 1/20 0.51
▸ CSF1R P07333 3/20 0.49
▸ LYN P07948 3/20 0.49
▸ INSR P06213 2/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ RET P07949 1/20 0.49
▸ IGF1R P08069 1/20 0.49
▸ MET P08581 1/20 0.49
▸ ROS1 P08922 1/20 0.49
▸ PDGFRB P09619 1/20 0.49
▸ FGR P09769 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ FLT1 P17948 1/20 0.49
▸ FGFR4 P22455 1/20 0.49

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
SCHEMBL396251 1.00 NTRK2 (0.85) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL398254 0.92 NTRK2 (1.00) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL398255 0.92 NTRK2 (1.00) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL395969 0.89 NTRK1 (0.85) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL395968 0.89 NTRK1 (0.85) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL396447 0.88 NTRK2 (0.85) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL396446 0.88 NTRK2 (0.85) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL5001015 0.86 NTRK2 (0.81) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL396973 0.84 NTRK2 (0.86) NTRK2NTRK1NTRK3SRCRAF1
SCHEMBL396974 0.84 NTRK2 (0.86) NTRK2NTRK1NTRK3SRCRAF1

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 4 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
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 — — 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 235/4885NTRK1 226/4885NTRK3 170/4885

“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.

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