SCHEMBL11069902

SCHEMBL11069902

CCCCCCCCCCSc1cc(S(=O)(=O)c2ccccc2)cc(C(=O)NC)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 0.41
PTGS2 P35354 3/20 0.39
HTR6 P50406 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
CA2 P00918 5/20 0.37
CA12 O43570 4/20 0.37
CA1 P00915 4/20 0.37
CA3 P07451 4/20 0.37
CA6 P23280 4/20 0.37
CA5A P35218 4/20 0.37
CA7 P43166 4/20 0.37
CA9 Q16790 4/20 0.37
CA13 Q8N1Q1 4/20 0.37
CA14 Q9ULX7 4/20 0.37
CA5B Q9Y2D0 4/20 0.37
CA4 P22748 3/20 0.37
PPARG P37231 1/20 0.37
EPHX2 P34913 1/20 0.36
METAP2 P50579 1/20 0.35

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
SCHEMBL11072034 0.75 ALDH1A1 (0.37) PLK1PTGS2CYSLTR2CYSLTR1
SCHEMBL11071900 0.70 MAPT (0.38) CA2CA1
SCHEMBL11069899 0.68 SOAT1 (0.39) PTGS2CYSLTR2CYSLTR1
SCHEMBL6525940 0.68 S1PR3 (0.60) PLK1PTGS2CYSLTR2CYSLTR1CA2
SCHEMBL231917 0.67 PTGS2 (0.58) PLK1PTGS2CYSLTR2CYSLTR1CA2
SCHEMBL9139729 0.67 PTGS2 (0.58) PLK1PTGS2CYSLTR2CYSLTR1CA2
SCHEMBL11768735 0.67 PTGS2 (0.58) PLK1PTGS2CYSLTR2CYSLTR1CA2
SCHEMBL11769795 0.67 PTGS2 (0.58) PLK1PTGS2CYSLTR2CYSLTR1CA2
SCHEMBL12080328 0.67 PTGS2 (0.58) PLK1PTGS2CYSLTR2CYSLTR1CA2
SCHEMBL11301411 0.67 PTGS2 (0.58) PLK1PTGS2CYSLTR2CYSLTR1CA2

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
US-4480105-A PHOTOCROSSLINKING POLYMERS CIBA-GEIGY CORPORATION (US) 1984-10-30 US disclosed
US-4363917-A SENSITIZERS FOR PHOTOCROSSLINKABLE POLYMERS; PHOTOPOLYMERIZATION INITIATORS CIBA-GEIGY CORPORATION (US) 1982-12-14 US disclosed