SCHEMBL7348763

SCHEMBL7348763

COc1ccc(CN(C(=O)CN2CCN(C)CC2)c2ccc(F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
TSHR P16473 2/20 0.53
KDM4E B2RXH2 1/20 0.53
OPRM1 P35372 1/20 0.52
LMNA P02545 4/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CHRM5 P08912 3/20 0.47
CHRM1 P11229 3/20 0.47
CHRM3 P20309 3/20 0.47
HPGD P15428 3/20 0.46
RNF4 P78317 1/20 0.46
MAPT P10636 2/20 0.45
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MC4R P32245 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
SCHEMBL7347840 0.94 MAPT (0.50) ALDH1A1TSHRKDM4EOPRM1LMNA
SCHEMBL7343295 0.90 RNF4 (0.46) ALDH1A1TSHRKDM4EOPRM1LMNA
SCHEMBL7346461 0.90 OPRM1 (0.53) ALDH1A1OPRM1CHRM5CHRM1CHRM3
SCHEMBL7347769 0.89 ALDH1A1 (0.52) ALDH1A1TSHRKDM4EOPRM1LMNA
SCHEMBL7341561 0.89 RNF4 (0.46) ALDH1A1TSHRKDM4EOPRM1LMNA
SCHEMBL7339267 0.89 BCL2A1 (0.57) ALDH1A1LMNACHRM5CHRM1CHRM3
SCHEMBL7349167 0.89 RNF4 (0.59) ALDH1A1TSHRKDM4EOPRM1LMNA
SCHEMBL7342184 0.88 RNF4 (0.47) ALDH1A1KDM4ELMNACHRM5CHRM1
SCHEMBL7346787 0.87 ALDH1A1 (0.56) ALDH1A1TSHRKDM4EOPRM1LMNA
SCHEMBL7350134 0.83 ALDH1A1 (0.52) ALDH1A1TSHRKDM4EOPRM1

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-0585500-A1 Diaryl piperazineacetamides as antimuscarinic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1994-03-09 EP disclosed