SCHEMBL8679002

SCHEMBL8679002

CCCCCCCCc1ccc(OC(CS(=O)(=O)O)OCC)cc1.[NaH]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 6/20 0.47
S1PR2 O95136 3/20 0.47
S1PR3 Q99500 2/20 0.47
PPARA Q07869 1/20 0.46
THRB P10828 2/20 0.43
THRA P10827 1/20 0.43
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
CYP3A4 P08684 2/20 0.41
KDM4E B2RXH2 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
HSPD1 P10809 1/20 0.41

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
SCHEMBL7114100 0.87 MEN1 (0.52) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL5490686 0.82 S1PR1 (0.48) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL9418699 0.81 ALDH1A1 (0.49) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL8365259 0.79 ALDH1A1 (0.44) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL19017732 0.75 PPARA (0.40) PPARATHRBTHRAESR1ADRA2A
SCHEMBL11794637 0.75 PPARA (0.50) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL5147935 0.75 FUT7 (0.40) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL9851290 0.74 PPARA (0.48) S1PR1S1PR2S1PR3PPARATHRB
SCHEMBL15672842 0.74 THRB (0.52) S1PR1S1PR2S1PR3THRBTHRA
SCHEMBL27635693 0.74 THRB (0.52) S1PR1S1PR2S1PR3THRBTHRA

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
US-5763152-A Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1998-06-09 US disclosed