SCHEMBL9594641

SCHEMBL9594641

CCN(CC)CCCCCC(=O)N1c2ccc(Cl)cc2NC(=O)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 13/20 0.55
CHRM4 P08173 2/20 0.54
CHRM1 P11229 2/20 0.54
CHRM3 P20309 2/20 0.54
CHRM5 P08912 1/20 0.46
ALOX15 P16050 1/20 0.46
DRD1 P21728 1/20 0.46
DRD5 P21918 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
DRD2 P14416 2/20 0.45

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
SCHEMBL9593883 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL9593547 0.99 CHRM2 (0.55) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL9593935 0.97 CHRM2 (0.54) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL9267548 0.92 CHRM2 (0.48) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL9594996 0.89 CHRM2 (0.66) CHRM2CHRM4CHRM1CHRM3CHRM5
Hydrochloric Acid SCHEMBL9593749 0.88 CHRM2 (0.65) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL9595120 0.87 DRD2 (0.46) CHRM2CHRM4CHRM1CHRM3DRD2
SCHEMBL9595138 0.87 DRD2 (0.46) CHRM2CHRM4CHRM1CHRM3DRD2
SCHEMBL9274492 0.86 CHRM2 (0.62) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL9594444 0.86 DRD2 (0.45) CHRM2CHRM4CHRM1CHRM3DRD2

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
US-5264432-A Antiarrhythmia and anticholinergic agents ARZNEIMITTELWERK DRESDEN G.M.B.H (DD) 1993-11-23 US claimed
US-5264432-A Antiarrhythmia and anticholinergic agents ARZNEIMITTELWERK DRESDEN G.M.B.H (DD) 1993-11-23 US disclosed