SCHEMBL3496203

SCHEMBL3496203

COc1ccc(Nc2ncc(F)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc1OC(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.57
ULK1 O75385 1/20 0.55
ULK2 Q8IYT8 1/20 0.55
CCNA2 P20248 1/20 0.48
CDK2 P24941 1/20 0.48
PLK1 P53350 1/20 0.48
CCNA1 P78396 1/20 0.48
BCL6 P41182 2/20 0.48
KIT P10721 1/20 0.44
FLT3 P36888 1/20 0.44
EGFR P00533 6/20 0.44
ITK Q08881 3/20 0.44
SYK P43405 3/20 0.44
AURKA O14965 2/20 0.42
AURKB Q96GD4 1/20 0.42
BRD4 O60885 2/20 0.42
ALK Q9UM73 1/20 0.42
BTK Q06187 2/20 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
SCHEMBL3494648 0.94 PRKCQ (0.61) PRKCQULK1ULK2BCL6EGFR
SCHEMBL3496091 0.91 PRKCQ (0.55) PRKCQULK1ULK2CCNA2CDK2
SCHEMBL3494246 0.90 PRKCQ (0.53) PRKCQULK1ULK2CCNA2CDK2
SCHEMBL3496562 0.90 PRKCQ (0.53) PRKCQULK1ULK2CCNA2CDK2
SCHEMBL3495061 0.90 PRKCQ (0.61) PRKCQULK1ULK2BCL6EGFR
SCHEMBL13270167 0.89 PRKCQ (0.57) PRKCQULK1ULK2BCL6EGFR
SCHEMBL3494060 0.89 PRKCQ (0.57) PRKCQULK1ULK2BCL6KIT
SCHEMBL3494008 0.89 PRKCQ (0.57) PRKCQULK1ULK2BCL6EGFR
SCHEMBL1741121 0.89 PRKCQ (0.57) PRKCQULK1ULK2BCL6EGFR
SCHEMBL3496557 0.88 PRKCQ (0.56) PRKCQULK1ULK2BCL6EGFR

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 PRKCQ 3/4885ULK1 832/4885ULK2 407/4885

“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.