SCHEMBL9818499

SCHEMBL9818499

Nc1cc(NS(N)(=O)=O)ccc1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 6/20 0.57
▸ CA2 P00918 6/20 0.57
▸ PRMT1 Q99873 2/20 0.49
▸ FFAR1 O14842 1/20 0.46
▸ FFAR4 Q5NUL3 1/20 0.46
▸ CA12 O43570 4/20 0.45
▸ CA9 Q16790 4/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ POLB P06746 1/20 0.44
▸ CES1 P23141 1/20 0.44
▸ CYP19A1 P11511 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ CCR2 P41597 1/20 0.41
▸ CA3 P07451 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA6 P23280 1/20 0.41
▸ CA5A P35218 1/20 0.41

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
SCHEMBL9818471 0.85 CA1 (0.57) CA1CA2FFAR4CA12CA9
SCHEMBL5261746 0.81 MEN1 (0.57) CA1CA2PRMT1CA12CA9
SCHEMBL9818411 0.75 APP (0.57) FFAR4MEN1KMT2APOLBALDH1A1
SCHEMBL1645913 0.75 CA1 (1.00) CA1CA2PRMT1CA12CA9
SCHEMBL8521142 0.73 CA12 (0.52) CA1CA2CA12CA9MEN1
SCHEMBL9722737 0.73 MEN1 (0.47) CA2MEN1KMT2APOLBALDH1A1
SCHEMBL3278551 0.72 POLB (0.51) MEN1KMT2APOLBALDH1A1CYP3A4
SCHEMBL9818418 0.72 ALDH1A1 (0.51) CA2PRMT1MEN1KMT2APOLB
SCHEMBL9818442 0.71 ALDH1A1 (0.46) CA1CA2FFAR4MEN1KMT2A
SCHEMBL9818477 0.71 HPGD (0.59) FFAR4MEN1KMT2AALDH1A1MAPK1

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
US-4997921-A Substituted phenylazosulfoindole dyes CIBA-GEIGY CORPORATION (US) 1991-03-05 — — US disclosed
US-4954563-A Polyamide dye CIBA-GEIGY CORPORATION (US) 1990-09-04 — — US disclosed
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