SCHEMBL3496589

SCHEMBL3496589

CN1C(C)(C)CC(Nc2nc(Nc3ccc(N4CCCC4)c(C(F)(F)F)c3)ncc2F)CC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.50
CDK2 P24941 7/20 0.45
CCNA2 P20248 6/20 0.45
CCNA1 P78396 6/20 0.45
BRD4 O60885 2/20 0.45
CDK4 P11802 3/20 0.44
CSF1R P07333 2/20 0.44
CDK6 Q00534 1/20 0.44
PIM1 P11309 2/20 0.44
CCND3 P30281 2/20 0.44
GSK3B P49841 2/20 0.44
KDR P35968 2/20 0.43
CHEK1 O14757 2/20 0.43
EGFR P00533 2/20 0.43
KIT P10721 2/20 0.43
FLT3 P36888 2/20 0.43
SYK P43405 2/20 0.43
CDC7 O00311 1/20 0.43
PLK4 O00444 1/20 0.43
AURKA O14965 1/20 0.43

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
SCHEMBL3494951 0.99 PRKCQ (0.49) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL1741267 0.94 CDK2 (0.53) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL3492850 0.93 PRKCQ (0.48) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL3495242 0.93 PRKCQ (0.48) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL3497025 0.93 PRKCQ (0.48) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL3495029 0.91 PRKCQ (0.47) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL3495931 0.90 PRKCQ (0.47) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL1741976 0.90 BRD4 (0.48) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL13248964 0.90 ALK (0.49) PRKCQCDK2CCNA2CCNA1BRD4
SCHEMBL3495939 0.89 PRKCQ (0.48) PRKCQCDK2CCNA2CCNA1BRD4

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 3/4885CDK2 129/4885CCNA2 1000/4885

“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.