SCHEMBL10579292

SCHEMBL10579292

Cc1ccc(S(=O)(=O)c2cc(NC(=O)OC(C)C)ccc2N)cc1S(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.48
▸ HPGD P15428 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ CTDSP1 Q9GZU7 1/20 0.40
▸ CASR P41180 1/20 0.40
▸ MMP12 P39900 2/20 0.39
▸ MMP13 P45452 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CA12 O43570 3/20 0.38
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CA9 Q16790 3/20 0.38
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 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
SCHEMBL10582790 0.89 CTDSP1 (0.40) KDM4ECTDSP1SMN1; SMN2NPC1RAB9A
SCHEMBL10579484 0.86 CTDSP1 (0.46) KDM4EHPGDCTDSP1MMP12MMP13
SCHEMBL10582238 0.84 ENPP2 (0.50) MMP13NPC1CYP2C19CA12CA1
SCHEMBL10582404 0.83 SMN1; SMN2 (0.44) KDM4EHPGDCTDSP1MMP12MMP13
SCHEMBL10581128 0.83 RAD51 (0.48) KDM4ECTDSP1MMP12MMP13CYP1A2
SCHEMBL10581025 0.83 SMN1; SMN2 (0.39) HPGDCTDSP1SMN1; SMN2NPC1RAB9A
SCHEMBL10578792 0.83 SMN1; SMN2 (0.42) KDM4EHPGDSMN1; SMN2NPC1RAB9A
SCHEMBL10583968 0.82 SMN1; SMN2 (0.39) KDM4EHPGDCTDSP1SMN1; SMN2NPC1
SCHEMBL10580263 0.82 MAPT (0.50) KDM4ECTDSP1SMN1; SMN2CA12CA1
SCHEMBL10581643 0.82 KMT2A (0.46) CA12CA1CA2CA9KMT2A

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
US-4843151-A RED/YELLOW DYES FOR NATURAL AND SYNTHETIC POLYAMIDES USING AN AQUEOUS BATH; COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1989-06-27 — — US disclosed
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