SCHEMBL9818408

SCHEMBL9818408

Cc1ccc(S(=O)(=O)c2ccc(C(N)=O)cc2N)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.55
▸ GAA P10253 3/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ PKM P14618 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ HSD11B1 P28845 1/20 0.48
▸ POLB P06746 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ APOBEC3A P31941 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ APOBEC3G Q9HC16 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP3A4 P08684 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ HSD17B13 Q7Z5P4 1/20 0.43
▸ CA2 P00918 1/20 0.42
▸ PARP1 P09874 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
SCHEMBL9818418 0.85 ALDH1A1 (0.51) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL9818407 0.82 GAA (0.56) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL9299326 0.80 ALDH1A1 (0.51) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL9722812 0.78 CA2 (0.57) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL3278551 0.76 POLB (0.51) ALDH1A1GAAKDM4EHSD11B1POLB
SCHEMBL8143772 0.76 HTR6 (0.52) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL9818411 0.73 APP (0.57) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL5261185 0.73 BCHE (0.47) ALDH1A1GAAKDM4EHPGDHSD11B1
SCHEMBL9818432 0.72 HTR6 (0.61) ALDH1A1GAAKDM4EPKMHPGD
SCHEMBL2004711 0.72 HTR6 (0.71) ALDH1A1GAAKDM4EL3MBTL1MEN1

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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