SCHEMBL20053663

SCHEMBL20053663

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC[C@@H]4C(N)=O)c(F)c3)cc2C#N)CC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
XDH P47989 5/20 0.40
CNR2 P34972 4/20 0.38

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
SCHEMBL20053538 0.98 XDH (0.38) XDHCNR2
SCHEMBL16803851 0.92 CNR2 (0.41) CNR2
SCHEMBL16803852 0.92 CNR2 (0.41) CNR2
SCHEMBL20053621 0.91 XDH (0.37) XDHCNR2
SCHEMBL16803737 0.90 CNR2 (0.40) CNR2
SCHEMBL16769041 0.88 CNR2 (0.37) XDHCNR2
SCHEMBL20053699 0.88 XDH (0.42) XDHCNR2
SCHEMBL16803938 0.88 PARP10 (0.40) CNR2
SCHEMBL16803884 0.88 PARP10 (0.43) CNR2
SCHEMBL16803888 0.88 PARP10 (0.43) CNR2

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-9944600-B2 Piperidine derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-04-17 US disclosed