SCHEMBL19367490

SCHEMBL19367490

CC(C)c1nc2[nH]cnc2cc1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.33

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
SCHEMBL14602869 0.78 HPGD (0.36) PDPK1
SCHEMBL16982068 0.72 FEN1 (0.36) —
SCHEMBL14602895 0.70 TRPA1 (0.37) —
SCHEMBL11370541 0.70 PDE3B (0.36) —
SCHEMBL25722773 0.68 PARP1 (0.31) —
SCHEMBL22792806 0.68 APP (0.32) —
SCHEMBL22699769 0.68 KDM4E (0.41) —
SCHEMBL24868619 0.67 QPCT (0.32) —
SCHEMBL25514529 0.66 MAPT (0.50) PDPK1
SCHEMBL22743385 0.65 KDM4E (0.35) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9765030-B2 Benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-09-19 — — US disclosed
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