SCHEMBL10387774

SCHEMBL10387774

C=CCc1ccc(C(C)=O)cc1S(N)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.43
▸ PKM P14618 2/20 0.42
▸ POLB P06746 2/20 0.41
▸ CA2 P00918 6/20 0.40
▸ CA1 P00915 4/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ STS P08842 1/20 0.37
▸ ELANE P08246 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB2 P47870 1/20 0.36
▸ NEU3 Q9UQ49 1/20 0.35

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
SCHEMBL10386745 0.87 HTT (0.41) HTTPKMPOLBALDH1A1LMNA
SCHEMBL10386991 0.85 HTT (0.40) HTTPKMPOLBALDH1A1LMNA
SCHEMBL10386884 0.85 HTT (0.40) HTTPKMPOLBALDH1A1LMNA
SCHEMBL10386990 0.84 POLB (0.40) HTTPKMPOLBALDH1A1LMNA
SCHEMBL10387154 0.83 HSD17B1 (0.46) HTTPKMPOLBCA2CA1
SCHEMBL1091841 0.80 HTT (0.53) HTTPKMPOLBALDH1A1LMNA
SCHEMBL29645074 0.80 HTT (0.53) HTTPKMPOLBALDH1A1LMNA
SCHEMBL1092424 0.76 HTT (0.71) HTTPKMPOLBALDH1A1LMNA
SCHEMBL9285697 0.76 XDH (0.46) POLBCA2CA1CA9ALDH1A1
SCHEMBL12093774 0.76 HTT (0.45) HTTPKMPOLBALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0162404-B1 PROCESS FOR PREPARING 2-ALKYL-5-HALOACETYLBENZENESULFONAMIDE SEITETSU KAGAKU CO., LTD. (JP) 1988-08-24 — — EP claimed
EP-0162404-A2 Process for preparing 2-alkyl-5-haloacetylbenzenesulfonamide SEITETSU KAGAKU CO., LTD. (JP) 1985-11-27 — — EP claimed
JP-61072744-A — — None — — JP disclosed
JP-61251653-A — — None — — JP disclosed
JP-58118557-A — — None — — JP disclosed
US-4943655-A INTERMEDIATE FOR AGRICULTURAL CHEMICALS AND PHARMACEUTICALS SEITETSU KAGAKU CO., LTD. (JP) 1990-07-24 — — US disclosed
US-4943655-A INTERMEDIATE FOR AGRICULTURAL CHEMICALS AND PHARMACEUTICALS SEITETSU KAGAKU CO., LTD. (JP) 1990-07-24 — — US disclosed
US-4853158-A CHEMICAL INTERMEDIATES; HYPOTENSIVE AGENTS SEITETSU KAGAKU CO., LTD. (JP) 1989-08-01 — — US disclosed
US-4853158-A CHEMICAL INTERMEDIATES; HYPOTENSIVE AGENTS SEITETSU KAGAKU CO., LTD. (JP) 1989-08-01 — — US disclosed
EP-0162404-B1 PROCESS FOR PREPARING 2-ALKYL-5-HALOACETYLBENZENESULFONAMIDE SEITETSU KAGAKU CO., LTD. (JP) 1988-08-24 — — EP disclosed
JP-S61251653-A CONTINUOUS PRODUCTION OF 5-ACETYL-2-ALKYLBENZENE SULFONAMIDE COMPOUND SANKYO KAGAKU KK 1986-11-08 — — JP disclosed
JP-S6172744-A PREPARATION OF 2-ALKYL-5-HALOACETYLBENZENE SULFONAMIDE SEITETSU KAGAKU CO LTD 1986-04-14 — — JP disclosed
EP-0162404-A2 Process for preparing 2-alkyl-5-haloacetylbenzenesulfonamide SEITETSU KAGAKU CO., LTD. (JP) 1985-11-27 — — EP disclosed
JP-S58118557-A PREPARATION OF 5-ACETYL-2-ALKYLBENZENESULFONAMIDE SEITETSU KAGAKU CO LTD 1983-07-14 — — JP disclosed
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