SCHEMBL6616511

SCHEMBL6616511

O=C1CC(CN2CCC(Cc3cc(F)ccc3Br)CC2)NC(=O)N1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.40
HTR1A P08908 3/20 0.39
ATM Q13315 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL6615341 0.91 SLC6A4 (0.42) SLC6A4HTR1AHTR2AHTR2C
SCHEMBL6613538 0.89 SLC6A4 (0.39) SLC6A4HTR1AATMOPRM1OPRL1
SCHEMBL6614632 0.89 SLC6A4 (0.40) SLC6A4HTR1AATM
SCHEMBL6617273 0.86 HTR1A (0.56) SLC6A4HTR1A
SCHEMBL6615250 0.85 MEN1 (0.43) SLC6A4HTR1AATM
SCHEMBL6617746 0.85 HTR1A (0.46) SLC6A4HTR1A
SCHEMBL6410656 0.85 SLC6A4 (0.43) SLC6A4HTR1AATM
SCHEMBL6413050 0.85 SLC6A4 (0.41) SLC6A4HTR1AATM
SCHEMBL6618081 0.84 HTR1A (0.46) SLC6A4HTR1A
SCHEMBL6614583 0.81 SLC6A4 (0.42) SLC6A4HTR1AATM

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-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP disclosed