SCHEMBL1925017

SCHEMBL1925017

CC(C)c1cc(C(=O)c2cncc(NC(=O)Nc3ccc4c(c3)OCO4)c2)c2c(N)ncnn12

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 2/20 0.63
▸ NTRK2 Q16620 3/20 0.61
▸ NPC1 O15118 11/20 0.43
▸ RAB9A P51151 11/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ TP53 P04637 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ PAX8 Q06710 1/20 0.41
▸ KLF5 Q13887 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ TSHR P16473 1/20 0.40
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ PLEC Q15149 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL1924731 0.90 NTRK1 (0.78) NTRK1NTRK2NPC1RAB9ASMN1; SMN2
SCHEMBL1924948 0.85 NTRK1 (0.69) NTRK1NTRK2
SCHEMBL3980576 0.85 NTRK1 (0.69) NTRK1NTRK2
SCHEMBL14537222 0.85 NTRK1 (0.67) NTRK1NTRK2
SCHEMBL1924266 0.84 NTRK1 (0.67) NTRK1NTRK2
SCHEMBL1925611 0.83 NTRK1 (0.71) NTRK1NTRK2NPC1RAB9APOLB
SCHEMBL1925029 0.83 NTRK1 (0.66) NTRK1NTRK2
SCHEMBL1926038 0.81 NTRK2 (0.72) NTRK1NTRK2
SCHEMBL1924102 0.81 NTRK1 (0.70) NTRK1NTRK2NPC1RAB9ASMN1; SMN2
SCHEMBL1924896 0.81 NTRK2 (0.69) NTRK1NTRK2NPC1RAB9ASMN1; SMN2

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 1/4885NPC1 3571/4885

“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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