SCHEMBL10694166

SCHEMBL10694166

Cc1ccc(S(=O)(=O)O)cc1CCCCCCCl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 1/20 0.37
YAP1 P46937 1/20 0.35
TEAD4 Q15561 1/20 0.35
SNCA P37840 1/20 0.34
ALDH1A1 P00352 6/20 0.33
HSD17B10 Q99714 2/20 0.33
LMNA P02545 3/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
MGLL Q99685 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL10694624 1.00 S1PR3 (0.37) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL10688796 1.00 S1PR3 (0.37) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL7709597 1.00 S1PR3 (0.37) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL10693387 1.00 S1PR3 (0.37) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL9148842 1.00 S1PR3 (0.37) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL10966413 1.00 S1PR3 (0.37) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL10693175 0.98 S1PR3 (0.35) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL6259776 0.94 S1PR3 (0.36) S1PR3YAP1TEAD4SNCAALDH1A1
SCHEMBL755115 0.87 YAP1 (0.38) YAP1TEAD4SNCAALDH1A1HSD17B10
SCHEMBL10598218 0.87 SNCA (0.39) S1PR3SNCAALDH1A1HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
US-4593029-A Enzyme inhibitor SYNTEX (U.S.A.) INC. (US) 1986-06-03 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed