SCHEMBL10276915

SCHEMBL10276915

COCCNCC(Nc1ccn2ncc(Br)c2n1)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 8/20 0.38
FYN P06241 1/20 0.33
FGFR4 P22455 1/20 0.32
PIM1 P11309 2/20 0.31
PIM2 Q9P1W9 1/20 0.31
TGFBR2 P37173 2/20 0.31
CAMK2D Q13557 1/20 0.31
ACVR2A P27037 1/20 0.31
TGFBR1 P36897 1/20 0.31
NTRK3 Q16288 1/20 0.30
PIK3CG P48736 1/20 0.30

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
SCHEMBL1441727 1.00 NTRK1 (0.38) NTRK1FYNFGFR4PIM1PIM2
SCHEMBL1440946 0.79 CDK2 (0.39) NTRK1FYNPIM1NTRK3
SCHEMBL1442102 0.79 PIM1 (0.36) NTRK1FYNPIM1PIM2NTRK3
SCHEMBL15261764 0.79 PIM1 (0.44) FYNFGFR4PIM1PIM2
SCHEMBL16083391 0.72 PIM1 (0.40) PIM1PIM2
SCHEMBL1438793 0.72 PIM1 (0.35) NTRK1FYNPIM1PIM2
SCHEMBL17464332 0.71 PIM1 (0.39) FYNPIM1PIM2
SCHEMBL23148335 0.69 NTRK1 (0.43) NTRK1NTRK3
SCHEMBL23148336 0.69 NTRK1 (0.43) NTRK1NTRK3
SCHEMBL20967402 0.68 TGFBR2 (0.49) NTRK1FYNPIM1PIM2TGFBR2

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-8865726-B2 Substituted pyrazolo[1,5-a]pyrimidine compounds as mTOR inhibitors ARRAY BIOPHARMA INC. (US) 2014-10-21 US disclosed
US-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-07-12 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-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS MTOR, RICTOR, EIF4EBP1 NTRK1 3204/4885FYN 2270/4885FGFR4 1719/4885

“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.