SCHEMBL3495334

SCHEMBL3495334

CN1C(C)(C)CC(Nc2nc(Nc3cc(-c4ccoc4)cc(C(F)(F)F)c3)ncc2F)CC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.50
TYRO3 Q06418 6/20 0.41
MERTK Q12866 5/20 0.41
CTSC P53634 5/20 0.40
AXL P30530 2/20 0.39
ULK1 O75385 5/20 0.35
EGFR P00533 1/20 0.35
BTK Q06187 1/20 0.35
IDH2 P48735 1/20 0.34
ULK2 Q8IYT8 1/20 0.34

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
SCHEMBL3495463 0.87 PRKCQ (0.52) PRKCQTYRO3MERTKCTSCAXL
SCHEMBL3496410 0.87 PRKCQ (0.57) PRKCQTYRO3MERTKCTSCAXL
SCHEMBL3495006 0.86 PRKCQ (0.51) PRKCQTYRO3MERTKAXLEGFR
SCHEMBL3494582 0.86 PRKCQ (0.51) PRKCQTYRO3MERTKAXLEGFR
SCHEMBL3495941 0.86 PRKCQ (0.53) PRKCQTYRO3MERTKCTSCAXL
SCHEMBL3496448 0.86 PRKCQ (0.50) PRKCQTYRO3MERTKCTSCAXL
SCHEMBL3496288 0.85 PRKCQ (0.48) PRKCQTYRO3MERTKAXLULK1
SCHEMBL3494094 0.84 PRKCQ (0.51) PRKCQTYRO3MERTKAXLEGFR
SCHEMBL3494800 0.83 PRKCQ (0.51) PRKCQTYRO3MERTKAXLEGFR
SCHEMBL3496186 0.83 PRKCQ (0.53) PRKCQTYRO3MERTKCTSCAXL

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 5 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
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 3/4885TYRO3 852/4885MERTK 573/4885

“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.