SCHEMBL10337478

SCHEMBL10337478

NC(=O)NS(=O)(=O)c1ccccc1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.66
CA2 P00918 3/20 0.66
MMP1 P03956 1/20 0.66
MMP2 P08253 1/20 0.66
MMP9 P14780 1/20 0.66
MMP8 P22894 1/20 0.66
MMP13 P45452 1/20 0.66
F2 P00734 3/20 0.64
PRSS1 P07477 3/20 0.64
PRSS2 P07478 3/20 0.64
PRSS3 P35030 3/20 0.64
CA9 Q16790 8/20 0.57
CA12 O43570 6/20 0.57
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
FABP4 P15090 2/20 0.45
FABP3 P05413 1/20 0.45
FABP5 Q01469 1/20 0.45

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
SCHEMBL7924259 0.87 F2 (0.49) CA1CA2MMP1MMP2MMP9
SCHEMBL13981195 0.82 CA1 (0.66) CA1CA2MMP1MMP2MMP9
SCHEMBL5924383 0.81 CA1 (0.70) CA1CA2MMP1MMP2MMP9
SCHEMBL6535568 0.81 CA1 (0.66) CA1CA2F2PRSS1PRSS2
SCHEMBL8397052 0.81 CA1 (0.75) CA1CA2MMP1MMP2MMP9
SCHEMBL32662843 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL7183304 0.79 MMP1 (1.00) CA1CA2MMP1MMP2MMP9
Hydrochloric Acid SCHEMBL11042768 0.79 CA1 (0.72) CA1CA2MMP1MMP2MMP9
SCHEMBL27428706 0.79 CA1 (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL4433906 0.78 CA1 (0.70) CA1CA2MMP1MMP2MMP9

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
EP-0127469-A2 Antidotes for sulfonylurea herbicides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-12-05 EP claimed
EP-0370644-A2 Herbicidal compounds ZENECA LIMITED (GB) 1990-05-30 EP disclosed
EP-0368592-A1 Herbicidal compositions IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-05-16 EP disclosed
US-4659366-A 2-(alkoximinoalkoxycarbonyl)-phenylsulphonylurea herbicides and fungicides BAYER AKTIENGESELLSCHAFT (DE) 1987-04-21 US disclosed
EP-0127469-A2 Antidotes for sulfonylurea herbicides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-12-05 EP disclosed