SCHEMBL26436007

SCHEMBL26436007

CC(C)N1CCC(N(C)C)(C(F)(F)F)C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
RORC P51449 1/20 0.32

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
SCHEMBL26441175 0.89 CYP2D6 (0.39) CYP2D6
SCHEMBL25005994 0.72 CYP2D6 (0.33) CYP2D6
SCHEMBL20315411 0.71 CYP2D6 (0.32) CYP2D6RORC
SCHEMBL25005266 0.71 CYP2D6 (0.32) CYP2D6
SCHEMBL26436006 0.70
SCHEMBL19910580 0.69 OPRM1 (0.34) CYP2D6RORC
SCHEMBL25724091 0.69 OPRM1 (0.34) CYP2D6RORC
SCHEMBL20328004 0.69 CYP2D6 (0.32) CYP2D6
SCHEMBL20412692 0.69 CYP2D6 (0.35) CYP2D6
SCHEMBL27420506 0.68 CYP2D6 (0.37) CYP2D6

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
WO-2023066204-A1 SIK INHIBITOR, COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海美悦生物科技发展有限公司 2023-04-27 WO disclosed