SCHEMBL3496041

SCHEMBL3496041

CC(C)Oc1ccc(Nc2ncc(F)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.53
BCL6 P41182 11/20 0.51
NCOR2 Q9Y618 2/20 0.47
SYK P43405 3/20 0.45
BRD4 O60885 2/20 0.44
EGFR P00533 2/20 0.41
ITK Q08881 1/20 0.41

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
SCHEMBL3495051 0.90 BCL6 (0.63) PRKCQBCL6NCOR2SYKBRD4
SCHEMBL3494008 0.90 PRKCQ (0.57) PRKCQBCL6NCOR2SYKBRD4
SCHEMBL1740898 0.88 PRKCQ (0.51) PRKCQBCL6SYKBRD4EGFR
SCHEMBL3496562 0.88 PRKCQ (0.53) PRKCQBCL6NCOR2SYKEGFR
SCHEMBL1742552 0.87 PRKCQ (0.53) PRKCQBCL6SYKBRD4EGFR
SCHEMBL3495845 0.87 PRKCQ (0.56) PRKCQBCL6SYKBRD4EGFR
SCHEMBL3496315 0.87 PRKCQ (0.56) PRKCQBCL6SYKEGFR
SCHEMBL1740715 0.86 PRKCQ (0.50) PRKCQBCL6SYKBRD4EGFR
SCHEMBL3505161 0.86 PRKCQ (0.51) PRKCQBCL6NCOR2SYKEGFR
SCHEMBL3497111 0.86 BCL6 (0.61) PRKCQBCL6NCOR2SYKEGFR

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 5 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
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 PRKCQ 3/4885BCL6 3211/4885NCOR2 4354/4885

“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.