SCHEMBL3494481

SCHEMBL3494481

COc1cc(Nc2ncc(C)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc(OC)c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.63
JAK1 P23458 6/20 0.44
BRD4 O60885 5/20 0.44
JAK2 O60674 3/20 0.44
JAK3 P52333 3/20 0.44
ULK1 O75385 1/20 0.43
ULK2 Q8IYT8 1/20 0.43
IGF1R P08069 2/20 0.43
SYK P43405 1/20 0.40
CYP3A4 P08684 1/20 0.40
AXL P30530 1/20 0.40
TYRO3 Q06418 1/20 0.40
MERTK Q12866 1/20 0.40
USP2 O75604 1/20 0.39
CYP1A2 P05177 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39

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
SCHEMBL3496305 0.89 PRKCQ (0.60) PRKCQBRD4ULK1ULK2IGF1R
SCHEMBL3495607 0.88 PRKCQ (0.59) PRKCQJAK1BRD4JAK2JAK3
SCHEMBL3492920 0.88 PRKCQ (0.75) PRKCQBRD4ULK1ULK2SYK
SCHEMBL3496953 0.88 PRKCQ (0.59) PRKCQBRD4ULK1ULK2IGF1R
SCHEMBL3495644 0.88 BRD4 (0.55) PRKCQJAK1BRD4JAK2JAK3
SCHEMBL3494857 0.87 PRKCQ (0.50) PRKCQJAK1BRD4JAK2JAK3
SCHEMBL3495246 0.87 PRKCQ (0.85) PRKCQJAK1BRD4JAK2JAK3
SCHEMBL3494403 0.86 PRKCQ (0.57) PRKCQBRD4ULK1ULK2IGF1R
SCHEMBL3496516 0.86 PRKCQ (0.57) PRKCQBRD4ULK1ULK2IGF1R
SCHEMBL3496345 0.86 ULK1 (0.62) PRKCQULK1ULK2

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 3/4885JAK1 292/4885BRD4 1173/4885

“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.