SCHEMBL10360643

SCHEMBL10360643

NC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(C(=O)NCCN2CCC(c3ccccc3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 8/20 0.55
CHRM2 P08172 2/20 0.49
CHRM5 P08912 2/20 0.49
CHRM1 P11229 2/20 0.49
CHRM3 P20309 2/20 0.49
DRD2 P14416 4/20 0.48
DRD3 P35462 3/20 0.48
OPRM1 P35372 2/20 0.46
OPRK1 P41145 2/20 0.46
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRA2A P08913 1/20 0.46
KCNE1 P15382 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
HRH2 P25021 1/20 0.46
HTR2A P28223 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL10361032 0.89 CHRM2 (0.47) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10360158 0.89 CHRM2 (0.46) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10548802 0.88 DRD2 (0.48) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10360087 0.87 LMNA (0.53) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10360471 0.86 CHRM4 (0.53) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10360474 0.86 DRD2 (0.56) CHRM4CHRM2DRD2DRD3
SCHEMBL10546026 0.84 CHRM4 (0.48) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10360086 0.82 ACKR3 (0.49) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10868180 0.82 DRD2 (0.57) CHRM4CHRM2CHRM5CHRM1CHRM3
SCHEMBL10360146 0.81 HTR1A (0.48) CHRM4CHRM2CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0178947-B1 1-[(Aminoalkyl and aminoalkylamino)carbonyl and thiocarbonyl]-alpha,alpha-diarylpyrrolidine, piperidine and homopiperidineacetamides and acetonitriles A.H. ROBINS COMPANY, INCORPORATED (US) 1990-09-26 EP disclosed
US-4812452-A ANTIARRHYTHMIA AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-14 US disclosed
US-4812451-A ANTIARRHYTHMIA AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-14 US disclosed
US-4810703-A ANTIARRHYTHMIA A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-07 US disclosed
US-4594343-A FOR DEEP FAT FRYING VAT OIL; REMOVING CONTAMINANTS; RESTAURANTS A.H. ROBINS COMPANY, INCORPORATED, A DE CORP. 1986-06-10 US disclosed
EP-0178947-A2 1-[(Aminoalkyl and aminoalkylamino)carbonyl and thiocarbonyl]-alpha,alpha-diarylpyrrolidine, piperidine and homopiperidineacetamides and acetonitriles A.H. ROBINS COMPANY, INCORPORATED (US) 1986-04-23 EP disclosed