SCHEMBL3497348

SCHEMBL3497348

COc1ccc(Nc2ncc(F)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc1-c1ccncc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.55
BCL6 P41182 6/20 0.46
ULK1 O75385 1/20 0.44
ULK2 Q8IYT8 1/20 0.44
NCOR2 Q9Y618 1/20 0.41
RET P07949 1/20 0.41
KIF5B P33176 1/20 0.41
KDR P35968 1/20 0.41
ETV6 P41212 1/20 0.41
KCNH2 Q12809 1/20 0.41
CCDC6 Q16204 1/20 0.41
EGFR P00533 5/20 0.41
BRAF P15056 1/20 0.41
ITK Q08881 2/20 0.41
AURKA O14965 2/20 0.41
AURKB Q96GD4 1/20 0.41
ALK Q9UM73 1/20 0.40
AXL P30530 1/20 0.40
TYRO3 Q06418 1/20 0.40
BTK Q06187 2/20 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
SCHEMBL3497299 0.92 PRKCQ (0.56) PRKCQBCL6ULK1ULK2RET
SCHEMBL3494377 0.91 PRKCQ (0.53) PRKCQBCL6RETKDREGFR
SCHEMBL3495518 0.91 PRKCQ (0.49) PRKCQBCL6ULK1ULK2EGFR
SCHEMBL3495756 0.89 PRKCQ (0.54) PRKCQBCL6ULK1ULK2RET
SCHEMBL3495264 0.89 PRKCQ (0.53) PRKCQBCL6RETKDREGFR
SCHEMBL3496602 0.89 PRKCQ (0.53) PRKCQBCL6RETKDREGFR
SCHEMBL3495227 0.88 PRKCQ (0.53) PRKCQBCL6ULK1ULK2NCOR2
SCHEMBL3495061 0.88 PRKCQ (0.61) PRKCQBCL6ULK1ULK2EGFR
SCHEMBL3494648 0.88 PRKCQ (0.61) PRKCQBCL6ULK1ULK2RET
SCHEMBL3496525 0.87 PRKCQ (0.53) PRKCQBCL6RETKDREGFR

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 3/4885BCL6 3211/4885ULK1 832/4885

“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.