SCHEMBL7112997

SCHEMBL7112997

CS(=O)(=O)NC1CCC(c2c[nH]c3ccc(C#N)cc23)C1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 17/20 0.74
HTR1A P08908 1/20 0.61
DRD1 P21728 1/20 0.61
SLC6A2 P23975 1/20 0.61
HTR1B P28222 1/20 0.61
HTR2A P28223 1/20 0.61
HTR6 P50406 1/20 0.61
SLC6A3 Q01959 1/20 0.61

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
SCHEMBL6087334 0.85 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087825 0.85 SLC6A4 (0.82) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087821 0.85 SLC6A4 (0.82) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6088195 0.82 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087952 0.80 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6111589 0.77 SLC6A4 (0.75) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6086998 0.77 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087331 0.77 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087812 0.77 SLC6A4 (0.73) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087829 0.77 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B

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
WO-2004026236-A2 CYCLOPENTYL INDOLE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2004-04-01 WO claimed