SCHEMBL28754182

SCHEMBL28754182

OCSc1ccccc1Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
LMNA P02545 2/20 0.40
APOBEC3G Q9HC16 1/20 0.38
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GAA P10253 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
SLC29A1 Q99808 1/20 0.32

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
SCHEMBL13508978 0.80 HTR7 (0.67) HTR7MAOAMAOBCA1CA2
SCHEMBL9296265 0.76 HTR7 (0.52) HTR7MAOAMAOBCA1CA2
SCHEMBL31378718 0.76 HTR7 (0.52) HTR7MAOAMAOBCA1CA2
SCHEMBL14460773 0.76 HTR7 (0.62) HTR7MAOAMAOBCA1CA2
SCHEMBL1802193 0.76 HTR7 (0.57) HTR7MAOAMAOBCA1CA2
SCHEMBL23269520 0.76 MAOA (0.61) HTR7MAOAMAOBCA1CA2
SCHEMBL30421706 0.74 CYP1A2 (0.61) HTR7MAOAMAOBALDH1A1RAB9A
SCHEMBL7284578 0.73 MEN1 (0.58) LMNAAPOBEC3GALDH1A1MAPK1RAB9A
SCHEMBL17195662 0.73 HTR7 (0.63) HTR7MAOAMAOBCA1CA2
SCHEMBL4334230 0.73 POLB (0.61) HTR7MAOAMAOBCA1CA2

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
CN-100334092-C Process for producing cyclic thioether and synthetic intermediate thereof SANKYO CO (JP) 2007-08-29 CN disclosed
CN-1675221-A Process for producing cyclic thioether and synthetic intermediate thereof SANKYO CO (JP) 2005-09-28 CN disclosed