SCHEMBL9566724

SCHEMBL9566724

O=S(=O)(O)c1cc(O)c(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.50
TSHR P16473 4/20 0.50
HPGD P15428 3/20 0.50
CA1 P00915 5/20 0.41
CA2 P00918 5/20 0.41
CA12 O43570 4/20 0.41
CA3 P07451 4/20 0.41
CA4 P22748 4/20 0.41
CA6 P23280 4/20 0.41
CA5A P35218 4/20 0.41
CA7 P43166 4/20 0.41
CA9 Q16790 4/20 0.41
CA14 Q9ULX7 4/20 0.41
CA5B Q9Y2D0 4/20 0.41
CA13 Q8N1Q1 3/20 0.41
CISD1 Q9NZ45 1/20 0.41
MPL P40238 2/20 0.36
NSD2 O96028 1/20 0.36
MMP14 P50281 1/20 0.36
CASP6 P55212 1/20 0.36

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
SCHEMBL9566720 0.91 HSD17B10 (0.50) HSD17B10TSHRHPGDCA1CA2
SCHEMBL10813290 0.89 HSD17B10 (0.48) HSD17B10TSHRHPGDCA1CA2
SCHEMBL5443614 0.85 CA1 (0.43) HSD17B10TSHRHPGDCA1CA2
Hydrochloric Acid SCHEMBL27559313 0.83 CA1 (0.41) HSD17B10TSHRHPGDCA1CA2
SCHEMBL29410051 0.83 L3MBTL1 (0.44) HSD17B10TSHRHPGDCA1CA2
Hydrochloric Acid SCHEMBL4426927 0.83 CA1 (0.41) HSD17B10TSHRHPGDCA1CA2
SCHEMBL27677330 0.83 CA1 (0.41) HSD17B10TSHRHPGDCA1CA2
SCHEMBL826419 0.83 L3MBTL1 (0.44) HSD17B10TSHRHPGDCA1CA2
SCHEMBL4565135 0.83 CA1 (0.39) HSD17B10TSHRHPGDCA1CA2
SCHEMBL2000643 0.81 L3MBTL1 (0.42) HSD17B10TSHRHPGDCA1CA2

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
JP-5286923-A None JP disclosed
JP-H05286923-A SEPARATION OF HYDROXYDICHLOROBENZENESULFONIC ACID SUMITOMO SEIKA CHEM CO LTD 1993-11-02 JP disclosed