SCHEMBL15322328

SCHEMBL15322328

CC1(C)CC[C@H]2C[C@@H](Nc3nc(Nc4ccc(OC5CCC5)c(OC(F)F)c4)ncc3F)CCN21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 13/20 0.40
▸ BCL6 P41182 2/20 0.40
▸ ITK Q08881 4/20 0.38
▸ BTK Q06187 4/20 0.37
▸ ULK1 O75385 1/20 0.37
▸ ULK2 Q8IYT8 1/20 0.37
▸ ALK Q9UM73 2/20 0.37
▸ AURKA O14965 1/20 0.37
▸ AURKB Q96GD4 1/20 0.37
▸ PRKCQ Q04759 1/20 0.35

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
SCHEMBL15320905 0.93 EGFR (0.40) EGFRBCL6ITKBTKULK1
SCHEMBL15323103 0.93 EGFR (0.39) EGFRBCL6ITKBTKULK1
SCHEMBL15321742 0.93 EGFR (0.39) EGFRBCL6ITKBTKULK1
SCHEMBL15320781 0.92 BCL6 (0.46) EGFRBCL6ITKBTKULK1
SCHEMBL15321507 0.89 EGFR (0.43) EGFRBCL6ITKBTKULK1
SCHEMBL15323803 0.88 EGFR (0.44) EGFRBCL6ITKBTKULK1
SCHEMBL15320769 0.88 EGFR (0.44) EGFRBCL6ITKBTKULK1
SCHEMBL15321049 0.88 ULK1 (0.44) EGFRBCL6ITKULK1ULK2
SCHEMBL15321535 0.88 EGFR (0.43) EGFRBCL6ITKBTKULK1
SCHEMBL15337527 0.88 EGFR (0.43) EGFRBCL6ITKBTKULK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2833889-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF Rigel Pharmaceuticals, Inc. (US) 2015-02-11 — — EP claimed
WO-2013152198-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS, INC. (US) 2013-10-10 — — WO claimed
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