SCHEMBL3497350

SCHEMBL3497350

CN1C(C)(C)CC(Nc2nc(Nc3ccc(O)cc3)ncc2F)CC1(C)C

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AURKA O14965 18/20 0.58
SYK P43405 1/20 0.58
PRKCQ Q04759 1/20 0.56
AURKB Q96GD4 1/20 0.52
EGFR P00533 1/20 0.47
BTK Q06187 1/20 0.47

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
SCHEMBL3493781 0.89 PRKCQ (0.56) AURKASYKPRKCQAURKBEGFR
SCHEMBL3497300 0.89 PRKCQ (0.59) AURKASYKPRKCQAURKBEGFR
SCHEMBL3494065 0.88 SYK (0.61) AURKASYKPRKCQAURKB
SCHEMBL3495899 0.87 PRKCQ (0.59) AURKASYKPRKCQAURKBEGFR
SCHEMBL3496536 0.87 AURKA (0.58) AURKASYKPRKCQAURKBEGFR
SCHEMBL3497975 0.86 SYK (0.61) AURKASYKPRKCQEGFRBTK
SCHEMBL3493976 0.86 PRKCQ (0.54) AURKASYKPRKCQAURKBEGFR
SCHEMBL3493447 0.85 CDK2 (0.55) AURKASYKPRKCQAURKB
SCHEMBL3495394 0.85 BRD4 (0.59) SYKPRKCQEGFRBTK
SCHEMBL3495184 0.85 PRKCQ (0.57) AURKASYKPRKCQEGFRBTK

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 AURKA 495/4885SYK 460/4885PRKCQ 3/4885

“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.