SCHEMBL3495607

SCHEMBL3495607

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.59
BRD4 O60885 6/20 0.55
JAK2 O60674 6/20 0.45
JAK1 P23458 6/20 0.45
CCNK O75909 2/20 0.44
CCNA2 P20248 2/20 0.44
CDK2 P24941 2/20 0.44
CCND3 P30281 2/20 0.44
CDK9 P50750 2/20 0.44
CDK6 Q00534 2/20 0.44
INSR P06213 1/20 0.43
ALK Q9UM73 1/20 0.43
ULK1 O75385 1/20 0.42
ULK2 Q8IYT8 1/20 0.42
AURKA O14965 3/20 0.42
TYK2 P29597 2/20 0.42
FLT3 P36888 2/20 0.42
JAK3 P52333 2/20 0.42
EGFR P00533 1/20 0.42
FGFR1 P11362 1/20 0.42

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
SCHEMBL3494481 0.88 PRKCQ (0.63) PRKCQBRD4JAK2JAK1ULK1
SCHEMBL3496305 0.88 PRKCQ (0.60) PRKCQBRD4ULK1ULK2EGFR
SCHEMBL3492920 0.88 PRKCQ (0.75) PRKCQBRD4ULK1ULK2AURKA
SCHEMBL3496953 0.88 PRKCQ (0.59) PRKCQBRD4ALKULK1ULK2
SCHEMBL3496523 0.85 STK17B (0.54) PRKCQBRD4INSRALKULK1
SCHEMBL3494403 0.85 PRKCQ (0.57) PRKCQBRD4ULK1ULK2
SCHEMBL3496516 0.85 PRKCQ (0.57) PRKCQBRD4ULK1ULK2EGFR
SCHEMBL3496345 0.85 ULK1 (0.62) PRKCQULK1ULK2FLT3EGFR
SCHEMBL3493830 0.83 PRKCQ (0.71) PRKCQBRD4ULK1ULK2AURKA
SCHEMBL3496431 0.82 PRKCQ (0.55) PRKCQBRD4JAK2JAK1CDK2

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 3/4885BRD4 1173/4885JAK2 268/4885

“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.