SCHEMBL9566720

SCHEMBL9566720

O=S(=O)(O)c1cc(Cl)c(O)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 4/20 0.39
CA2 P00918 4/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP3A4 P08684 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CA12 O43570 3/20 0.38
CA3 P07451 3/20 0.38
CA4 P22748 3/20 0.38
CA6 P23280 3/20 0.38
CA5A P35218 3/20 0.38
CA7 P43166 3/20 0.38
CA9 Q16790 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA5B Q9Y2D0 3/20 0.38
CA13 Q8N1Q1 2/20 0.37
CISD1 Q9NZ45 1/20 0.37
ACLY P53396 2/20 0.37

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
SCHEMBL10813290 0.98 HSD17B10 (0.48) HSD17B10TSHRHPGDCA1CA2
SCHEMBL9566724 0.91 HSD17B10 (0.50) HSD17B10TSHRHPGDCA1CA2
SCHEMBL9750079 0.88 TSHR (0.52) HSD17B10TSHRHPGDCA1CA2
SCHEMBL4565135 0.88 CA1 (0.39) HSD17B10TSHRHPGDCA1CA2
SCHEMBL1992615 0.85 CA1 (0.38) HSD17B10TSHRHPGDCA1CA2
SCHEMBL1989758 0.85 CA1 (0.38) HSD17B10TSHRHPGDCA1CA2
SCHEMBL6548470 0.84 HSD17B10 (0.46) HSD17B10TSHRHPGDCA1CA2
SCHEMBL826419 0.83 L3MBTL1 (0.44) HSD17B10TSHRHPGDCA1CA2
SCHEMBL29410051 0.83 L3MBTL1 (0.44) HSD17B10TSHRHPGDCA1CA2
SCHEMBL5635695 0.82 TSHR (0.50) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4670610-A Preparation of 2,5-dichlorophenol SANDOZ, INC. (CH) 1987-06-02 US claimed
JP-5286923-A None JP disclosed
JP-H05286923-A SEPARATION OF HYDROXYDICHLOROBENZENESULFONIC ACID SUMITOMO SEIKA CHEM CO LTD 1993-11-02 JP disclosed
US-4670610-A Preparation of 2,5-dichlorophenol SANDOZ, INC. (CH) 1987-06-02 US disclosed
US-4670610-A Preparation of 2,5-dichlorophenol SANDOZ, INC. (CH) 1987-06-02 US disclosed