SCHEMBL15537841

SCHEMBL15537841

CC(C)(C)N1CCC(CN(Cc2ccccc2)c2ccc(Br)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
CYP2C19 P33261 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM3 P20309 2/20 0.39
SLC6A2 P23975 6/20 0.39
SLC6A4 P31645 6/20 0.39
SLC6A3 Q01959 4/20 0.39
REN P00797 2/20 0.39
TSHR P16473 1/20 0.37
S1PR1 P21453 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.36

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
SCHEMBL15539893 0.84 ACHE (0.41) ACHECHRM2CHRM3SLC6A2SLC6A4
SCHEMBL15538825 0.84 CHRM2 (0.43) ACHECHRM2CHRM3SLC6A2SLC6A4
SCHEMBL15558242 0.82 ACHE (0.40) ACHECHRM2CHRM3SLC6A2SLC6A4
SCHEMBL15538837 0.80 KDM4E (0.50)
SCHEMBL15538277 0.80 NPC1 (0.42) CHRM2CHRM3SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL15540120 0.77 SLC6A2 (0.48) CYP2C19SLC6A2SLC6A4SLC6A3REN
SCHEMBL15539532 0.72 OPRD1 (0.40) ACHECYP2C19CHRM2CHRM3SLC6A2
SCHEMBL2586563 0.72 CYP2C19 (0.64) CYP2C19SLC6A3TSHR
SCHEMBL4544766 0.71 CCR3 (0.59)
SCHEMBL17282142 0.70 HRH3 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2858986-A1 PIPERIDINE DERIVATIVES FOR GPR119 AGONIST Chong Kun Dang Pharmaceutical Corp. (KR) 2015-04-15 EP disclosed
WO-2013187646-A1 PIPERIDINE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2013-12-19 WO disclosed