SCHEMBL3496302

SCHEMBL3496302

CN1C(C)(C)CC(Nc2nc(Nc3ccc4cnn(C)c4c3)ncc2F)CC1(C)C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.55
SYK P43405 12/20 0.51
CHEK1 O14757 1/20 0.42
FLT3 P36888 1/20 0.42
EML4 Q9HC35 1/20 0.41
ALK Q9UM73 1/20 0.41
EGFR P00533 1/20 0.40
SLC2A1 P11166 1/20 0.40
CYP1A2 P05177 1/20 0.40
GRM4 Q14833 1/20 0.40

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
SCHEMBL3497165 0.92 SYK (0.60) PRKCQSYKCHEK1FLT3EGFR
SCHEMBL3495899 0.87 PRKCQ (0.59) PRKCQSYKCHEK1FLT3ALK
SCHEMBL3495777 0.85 PRKCQ (0.53) PRKCQSYKCHEK1FLT3ALK
SCHEMBL3495520 0.84 PRKCQ (0.56) PRKCQSYKCHEK1FLT3ALK
SCHEMBL3495845 0.84 PRKCQ (0.56) PRKCQSYKEGFR
SCHEMBL3495568 0.84 PRKCQ (0.56) PRKCQSYKEGFR
SCHEMBL3496315 0.84 PRKCQ (0.56) PRKCQSYKEGFR
SCHEMBL3495022 0.83 PRKCQ (0.55) PRKCQSYKCHEK1FLT3ALK
SCHEMBL3497350 0.83 AURKA (0.58) PRKCQSYKEGFR
SCHEMBL3493781 0.83 PRKCQ (0.56) PRKCQSYKFLT3EGFR

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 3/4885SYK 460/4885CHEK1 184/4885

“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.