SCHEMBL9818366

SCHEMBL9818366

O=C(O)c1cc(NS(=O)(=O)Cc2ccccc2)cc(C(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.61
KMT2A Q03164 2/20 0.55
PGR P06401 1/20 0.53
HSD17B10 Q99714 3/20 0.52
ACLY P53396 1/20 0.52
ALOX15 P16050 1/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
MMP1 P03956 1/20 0.51
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51
MMP13 P45452 1/20 0.51
GAA P10253 2/20 0.51
AR P10275 1/20 0.51
HDAC1 Q13547 2/20 0.51
CYP19A1 P11511 1/20 0.49
TSHR P16473 1/20 0.49
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL720817 0.90 HPGD (0.58) HPGDKMT2APGRHSD17B10ACLY
SCHEMBL6797222 0.88 HPGD (0.58) HPGDKMT2APGRHSD17B10ACLY
SCHEMBL1650346 0.85 HPGD (0.77) HPGDKMT2APGRHSD17B10ACLY
SCHEMBL3560317 0.80 HPGD (0.69) HPGDKMT2APGRHSD17B10ALOX15
SCHEMBL3560661 0.80 HPGD (0.53) HPGDKMT2AALDH1A1
SCHEMBL3557393 0.79 HPGD (0.59) HPGDKMT2APGRHSD17B10ALOX15
SCHEMBL3556492 0.79 HPGD (0.56) HPGDKMT2APGRHSD17B10ACLY
SCHEMBL633995 0.79 KMT2A (0.76) HPGDKMT2APGRHSD17B10ALOX15
SCHEMBL8968190 0.78 HSD17B10 (0.50) HPGDKMT2AHSD17B10ACLYALOX15
SCHEMBL475722 0.78 HPGD (0.53) HPGDKMT2AGAAKDM4EMEN1

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
EP-0308820-B1 ZINC, LEAD, AND/OR CALCIUMSALTS OF CARBOXYLIC ACIDS AND THEIR USE AS ANTICORROSIVE AGENTS BASF Lacke + Farben AG (DE) 1991-11-27 EP disclosed
EP-0308820-A1 Zinc, lead, and/or calciumsalts of carboxylic acids and their use as anticorrosive agents BASF Lacke + Farben AG (DE) 1989-03-29 EP disclosed