SCHEMBL3496321

SCHEMBL3496321

CCN1CCN(c2ccc(Nc3ncc(F)c(NC4CC(C)(C)N(C)C(C)(C)C4)n3)cc2Cl)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 3/20 0.49
SYK P43405 6/20 0.47
NTRK1 P04629 2/20 0.46
KDR P35968 3/20 0.45
AURKA O14965 3/20 0.45
ALK Q9UM73 3/20 0.45
JAK3 P52333 3/20 0.45
PDGFRA P16234 3/20 0.45
DAPK3 O43293 2/20 0.45
JAK2 O60674 2/20 0.45
PRKD3 O94806 2/20 0.45
MAP4K4 O95819 2/20 0.45
PAK4 O96013 2/20 0.45
LCK P06239 2/20 0.45
FYN P06241 2/20 0.45
CSF1R P07333 2/20 0.45
RET P07949 2/20 0.45
IGF1R P08069 2/20 0.45
MET P08581 2/20 0.45
FGFR1 P11362 2/20 0.45

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
SCHEMBL3494282 0.94 PRKCQ (0.48) PRKCQSYKKDRAURKAALK
SCHEMBL3496889 0.94 PRKCQ (0.48) PRKCQSYKNTRK1KDRAURKA
SCHEMBL3499357 0.92 PRKCQ (0.47) PRKCQSYKKDRAURKAALK
SCHEMBL1743511 0.91 BRD4 (0.52) PRKCQSYKKDRAURKAALK
SCHEMBL3495029 0.90 PRKCQ (0.47) PRKCQSYKKDRAURKAALK
SCHEMBL3494926 0.89 PRKCQ (0.48) PRKCQSYKNTRK1KDRAURKA
SCHEMBL3495097 0.88 PRKCQ (0.50) PRKCQSYKKDRAURKAALK
SCHEMBL1741119 0.87 BRD4 (0.48) PRKCQSYKKDRAURKAALK
SCHEMBL3500576 0.86 PRKCQ (0.46) PRKCQSYKNTRK1KDRAURKA
SCHEMBL3495856 0.86 SYK (0.53) PRKCQSYKKDRAURKAALK

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 460/4885NTRK1 3132/4885

“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.