SCHEMBL11074688

SCHEMBL11074688

COc1nc(NC(=O)NS(=O)(=O)c2ccccc2C(=O)O)nc(OC)c1F

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
GAA P10253 2/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
CA12 O43570 4/20 0.41
CA9 Q16790 4/20 0.41
NPC1 O15118 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
FABP4 P15090 1/20 0.40

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
SCHEMBL11069468 0.91 GAA (0.47) MAPTGAACA1CA2CA9
SCHEMBL11076721 0.85 KDM4E (0.57) MAPTGAACA1CA2CA12
SCHEMBL11079469 0.85 NPC1 (0.43) MAPTGAACA1CA2MMP1
SCHEMBL7452390 0.85 MAPT (0.49) MAPTGAACA1CA2MMP1
SCHEMBL10469643 0.84 GAA (0.59) MAPTGAACA1CA2MMP1
SCHEMBL11069586 0.83 CYP3A4 (0.43) MAPTGAANPC1KDM4EALDH1A1
SCHEMBL9153788 0.82 ALDH1A1 (0.48) MAPTGAACA1CA2MMP1
SCHEMBL66269 0.81 MAPT (0.46) MAPTGAACA1CA2MMP1
SCHEMBL29396197 0.81 MAPT (0.46) MAPTGAACA1CA2MMP1
SCHEMBL30013512 0.81 MAPT (0.46) MAPTGAACA1CA2MMP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0023140-B1 HERBICIDAL SULFONAMIDES, PREPARATION AND USE THEREOF, AND COMPOSITIONS CONTAINING THEM E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP claimed