SCHEMBL9304790

SCHEMBL9304790

CN(CCc1ccccc1)C(C)(C)CCC1(c2ccccc2)CC(=O)NC(=O)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.36
OPRM1 P35372 4/20 0.34
OPRL1 P41146 4/20 0.34
AOC3 Q16853 1/20 0.34
FDPS P14324 1/20 0.34
ADRA2C P18825 2/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
SLC6A3 Q01959 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
HRH2 P25021 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
TACR1 P25103 2/20 0.31
SLC6A4 P31645 1/20 0.31
DDB1 Q16531 1/20 0.31

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
SCHEMBL9303673 0.93 CNR2 (0.34) TAAR1OPRM1OPRL1SIGMAR1TACR1
SCHEMBL9304060 0.92 KDM4E (0.36) OPRM1OPRL1FDPSTACR1SLC6A4
SCHEMBL9304467 0.92 UTS2R (0.35) AOC3SIGMAR1
SCHEMBL9302750 0.88 DDB1 (0.37) OPRM1OPRL1SLC6A3TACR1SLC6A4
SCHEMBL9869620 0.79 SIGMAR1 (0.49) TAAR1FDPSSLC6A3SIGMAR1SLC6A4
SCHEMBL9303006 0.73 LMNA (0.37) TAAR1OPRM1OPRL1HTR2AHTR2B
SCHEMBL9304044 0.73 SIGMAR1 (0.42) SLC6A3SIGMAR1SLC6A4
SCHEMBL9304202 0.73 SIGMAR1 (0.46) SIGMAR1
SCHEMBL9303707 0.68 SCN1A (0.38) SIGMAR1SLC6A4
SCHEMBL9467170 0.67 TSHR (0.47) TAAR1OPRM1OPRL1SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505379-B1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LTD (GB) 1994-07-20 EP disclosed
US-5300516-A Muscarinic receptor antagonists PFIZER INC. (US) 1994-04-05 US disclosed
WO-1991009014-A1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 1991-06-27 WO disclosed