SCHEMBL3495014

SCHEMBL3495014

COc1ccc(Nc2ncc(F)c(NC3CC(C)(C)N(C=CC(=O)O)C(C)(C)C3)n2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 9/20 0.53
SYK P43405 2/20 0.49
EGFR P00533 6/20 0.47
ITK Q08881 2/20 0.47
NCOR2 Q9Y618 1/20 0.47
BTK Q06187 2/20 0.46
PRKCQ Q04759 1/20 0.45
STK17B O94768 1/20 0.45
STK17A Q9UEE5 1/20 0.45
PTK2 Q05397 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
SCHEMBL3495010 1.00 BCL6 (0.53) BCL6SYKEGFRITKNCOR2
SCHEMBL3496403 0.93 EGFR (0.51) BCL6SYKEGFRITKBTK
SCHEMBL3496399 0.93 EGFR (0.51) BCL6SYKEGFRITKBTK
SCHEMBL3496278 0.89 ULK1 (0.50) BCL6EGFRITKBTKPRKCQ
SCHEMBL3496280 0.89 ULK1 (0.50) BCL6EGFRITKBTKPRKCQ
SCHEMBL3495275 0.87 BCL6 (0.56) BCL6SYKEGFRNCOR2PRKCQ
SCHEMBL3495051 0.86 BCL6 (0.63) BCL6SYKNCOR2PRKCQSTK17B
SCHEMBL3496369 0.85 PRKCQ (0.57) SYKEGFRITKBTKPRKCQ
SCHEMBL3496360 0.85 PRKCQ (0.57) SYKEGFRITKBTKPRKCQ
SCHEMBL3496082 0.85 BCL6 (0.55) BCL6SYKEGFRITKNCOR2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US claimed
EP-2183225-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2010-05-12 EP claimed
WO-2009012421-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2009-01-22 WO claimed
US-8993585-B2 Cyclic amine substituted pyrimidinediamines as PKC inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-03-31 US disclosed
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US disclosed
EP-2183225-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2010-05-12 EP disclosed
WO-2009012421-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2009-01-22 WO 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-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS PRKCH, PKD2, PRKCQ BCL6 3211/4885SYK 460/4885EGFR 1181/4885

“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.