SCHEMBL8714910

SCHEMBL8714910

CC(Cc1ccc(-c2ccccc2)cc1)(C[C@H](N)O)c1cccc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 9/20 0.43
TAAR1 Q96RJ0 2/20 0.41
MAOB P27338 2/20 0.39
PGR P06401 1/20 0.36
FFAR1 O14842 1/20 0.36
MME P08473 4/20 0.35
ACE P12821 3/20 0.35
PNMT P11086 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
SCHEMBL8717072 0.88 KIF11 (0.40) KIF11PNMT
SCHEMBL8713872 0.88 ESR1 (0.42) KIF11TAAR1PNMT
SCHEMBL8716173 0.88 KIF11 (0.40) KIF11PNMT
SCHEMBL8713320 0.87 ESR1 (0.38) KIF11TAAR1MMEACE
SCHEMBL8714644 0.86 KIF11 (0.44) KIF11
SCHEMBL8716720 0.84 CASR (0.49) KIF11
SCHEMBL8716326 0.84 PKM (0.49) KIF11MAOB
SCHEMBL8714176 0.83 MAOB (0.43) KIF11MAOB
SCHEMBL8713560 0.83 KIF11 (0.42) KIF11MAOB
SCHEMBL8713306 0.81 KIF11 (0.40) KIF11TAAR1PNMT

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-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed