SCHEMBL24158043

SCHEMBL24158043

CN1CCC(c2cccc(F)c2C(F)(F)F)CC1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 19/20 0.46
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL24727594 0.84 RBP4 (0.52) RBP4
SCHEMBL2781457 0.84 DRD2 (0.56) RBP4
SCHEMBL2782833 0.84 RBP4 (0.54) RBP4CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL24727974 0.83 RBP4 (0.45) RBP4CYP2D6
SCHEMBL5501124 0.81 DRD2 (0.52) RBP4
SCHEMBL2783595 0.81 RBP4 (0.58) RBP4
SCHEMBL17224411 0.81 RBP4 (0.45) RBP4CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL28146212 0.81 RBP4 (0.55) RBP4CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL29915616 0.81 RBP4 (0.45) RBP4CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL3768131 0.80 HTR6 (0.43)

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
EP-3137168-B1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE UNIV COLUMBIA (US) 2022-01-05 EP disclosed