SCHEMBL3495262

SCHEMBL3495262

COc1cc(Nc2ncc(C(F)(F)F)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc(-n2cnnn2)c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.59
LRRK2 Q5S007 1/20 0.52
ULK1 O75385 8/20 0.51
ULK2 Q8IYT8 3/20 0.51
SYK P43405 2/20 0.47
EGFR P00533 1/20 0.44
FLT3 P36888 5/20 0.42
KIT P10721 1/20 0.42
MAPK3 P27361 1/20 0.41

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
SCHEMBL3495008 0.90 PRKCQ (0.73) PRKCQLRRK2SYKEGFR
SCHEMBL3496345 0.88 ULK1 (0.62) PRKCQULK1ULK2EGFRFLT3
SCHEMBL3495601 0.86 PRKCQ (0.57) PRKCQLRRK2SYK
SCHEMBL3494848 0.85 SYK (0.63) PRKCQSYK
SCHEMBL3495110 0.85 PRKCQ (0.81) PRKCQLRRK2ULK1ULK2EGFR
SCHEMBL3497169 0.80 PRKCQ (0.60) PRKCQLRRK2SYKEGFR
SCHEMBL3746692 0.79 PRKCQ (0.53) PRKCQLRRK2ULK1ULK2EGFR
SCHEMBL3495605 0.77 PRKCQ (0.58) PRKCQSYKEGFR
SCHEMBL3494774 0.77 FLT3 (0.55) PRKCQULK1ULK2SYKEGFR
SCHEMBL3496002 0.77 SYK (0.47) PRKCQLRRK2SYK

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 3/4885LRRK2 311/4885ULK1 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.