SCHEMBL1924701

SCHEMBL1924701

CC(C)c1cc(C(=O)c2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)c2c(N)ncnn12

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 4/20 0.82
▸ NTRK2 Q16620 4/20 0.75
▸ KCNJ6 P48051 2/20 0.48
▸ KCNJ5 P48544 2/20 0.48
▸ KCNJ3 P48549 2/20 0.48
▸ ERN1 O75460 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PDGFRB P09619 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ RIPK1 Q13546 1/20 0.44
▸ KDR P35968 4/20 0.44
▸ AURKA O14965 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ CDK19 Q9BWU1 1/20 0.44

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
SCHEMBL1924204 0.94 NTRK1 (0.83) NTRK1NTRK2KCNJ6KCNJ5KCNJ3
SCHEMBL1924757 0.90 NTRK1 (1.00) NTRK1NTRK2MEN1KMT2APDGFRB
SCHEMBL1925139 0.88 NTRK1 (0.79) NTRK1NTRK2ERN1PDGFRBRIPK1
SCHEMBL1924695 0.88 NTRK1 (0.85) NTRK1NTRK2MAPTHTTRAB9A
SCHEMBL1925796 0.88 NTRK1 (0.84) NTRK1NTRK2KCNJ6KCNJ5KCNJ3
SCHEMBL1925269 0.88 NTRK1 (0.88) NTRK1NTRK2PDGFRBKDRAURKA
SCHEMBL1924937 0.88 NTRK1 (0.88) NTRK1NTRK2KCNJ6KCNJ5KCNJ3
SCHEMBL1924388 0.87 NTRK1 (0.83) NTRK1NTRK2KMT2APDGFRBKDR
SCHEMBL1925944 0.87 NTRK1 (0.83) NTRK1NTRK2KCNJ6KCNJ5KCNJ3
SCHEMBL1924680 0.87 NTRK1 (0.83) NTRK1NTRK2PDGFRBKDRAURKA

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
EP-1948664-B1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-06-08 — — EP disclosed
US-7514435-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-04-07 — — US disclosed
US-20070149534-A1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-28 — — 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-20070149534-A1 PYRROLOTRIAZINE KINASE INHIBITORS NTRK2, NTRK3, NTRK1 NTRK1 3/4885NTRK2 1/4885KCNJ6 886/4885

“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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