SCHEMBL3495033

SCHEMBL3495033

Cc1nccc(-c2cccc(Nc3ncc(F)c(NC4CC(C)(C)N(C)C(C)(C)C4)n3)c2)n1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 3/20 0.52
AURKA O14965 2/20 0.44
EGFR P00533 4/20 0.41
ITK Q08881 2/20 0.41
SYK P43405 6/20 0.40
BTK Q06187 2/20 0.40
KDR P35968 1/20 0.39
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
CDK9 P50750 3/20 0.39
CCNT1 O60563 2/20 0.39
CCNE1 P24864 2/20 0.39
CDK2 P24941 2/20 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
SCHEMBL3496849 0.86 PRKCQ (0.55) PRKCQAURKAEGFRITKSYK
SCHEMBL3494387 0.86 PRKCQ (0.53) PRKCQAURKAEGFRITKSYK
SCHEMBL3494881 0.85 PRKCQ (0.52) PRKCQAURKAEGFRITKSYK
SCHEMBL3495631 0.84 PRKCQ (0.52) PRKCQAURKAEGFRITKSYK
SCHEMBL3495006 0.83 PRKCQ (0.51) PRKCQAURKAEGFRITKSYK
SCHEMBL3494322 0.83 PRKCQ (0.52) PRKCQAURKAEGFRITKSYK
SCHEMBL3494095 0.82 PRKCQ (0.51) PRKCQAURKAEGFRITKSYK
SCHEMBL3496950 0.82 KDR (0.61) PRKCQAURKAEGFRITKSYK
SCHEMBL3494065 0.82 SYK (0.61) PRKCQAURKASYK
SCHEMBL3495168 0.81 PRKCQ (0.60) PRKCQAURKAEGFRITKSYK

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 3/4885AURKA 495/4885EGFR 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.