SCHEMBL7738352

SCHEMBL7738352

CCCCCCCCOc1ccc(C(C)(C)CC(C)(C)C)cc1S(=O)(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 1/20 0.49
ESR1 P03372 7/20 0.43
THRA P10827 2/20 0.43
THRB P10828 2/20 0.43
S1PR1 P21453 1/20 0.40
CYP3A4 P08684 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
PLA2G2D Q9UNK4 1/20 0.39
TRPV1 Q8NER1 1/20 0.38

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
Hydrochloric Acid SCHEMBL8314763 0.99 S1PR3 (0.48) S1PR3ESR1THRATHRBS1PR1
SCHEMBL7526658 0.88 ESR1 (0.41) S1PR3ESR1THRATHRBCYP3A4
SCHEMBL4524604 0.88 S1PR3 (0.52) S1PR3ESR1THRATHRBS1PR1
SCHEMBL9770224 0.87 ESR1 (0.43) S1PR3ESR1THRATHRBS1PR1
SCHEMBL6536665 0.87 ESR1 (0.43) S1PR3ESR1THRATHRBS1PR1
SCHEMBL5665416 0.87 ESR1 (0.41) S1PR3ESR1THRATHRBCYP3A4
SCHEMBL9770220 0.87 ESR1 (0.41) S1PR3ESR1THRATHRBCYP3A4
SCHEMBL7651309 0.87 ESR1 (0.41) S1PR3ESR1THRATHRBCYP3A4
SCHEMBL18531404 0.86 ESR1 (0.40) S1PR3ESR1THRATHRBS1PR1
SCHEMBL9731239 0.83 POLB (0.46) S1PR3ESR1THRATHRBCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432615-B1 COLOR FORMING FUJI PHOTO FILM CO., LTD. (JP) 2002-08-13 US disclosed
EP-0573761-B1 Method of forming coloured images FUJI PHOTO FILM CO LTD (JP) 1998-07-01 EP disclosed
US-5747227-A LASER EXPOSURE AND COLOR DEVELOPMENT USING CYCLIC DIAMIDE YELLOW DYE FORMING COUPLER; QUALITY FUJI PHOTO FILM CO., LTD. (JP) 1998-05-05 US disclosed
EP-0573761-A1 Method of forming coloured images FUJI PHOTO FILM CO., LTD. (JP) 1993-12-15 EP disclosed