SCHEMBL6865738

SCHEMBL6865738

NC(=O)c1ccc(S(=O)(=O)O)cc1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
HSD17B10 Q99714 4/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 3/20 0.45
NT5E P21589 2/20 0.45
TDP1 Q9NUW8 1/20 0.44
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA7 P43166 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CASP6 P55212 1/20 0.42
LMNA P02545 1/20 0.41
S1PR3 Q99500 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38

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
Ammonia Solution, Strong SCHEMBL7095002 0.98 ALDH1A1 (0.50) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL11344526 0.90 ALDH1A1 (0.61) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL11344523 0.90 ALDH1A1 (0.61) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL30873374 0.84 ALDH1A1 (0.53) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL28061848 0.84 ALDH1A1 (0.49) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL7460497 0.84 ALDH1A1 (0.68) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL28061801 0.84 ALDH1A1 (0.44) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL1806762 0.84 ALDH1A1 (0.58) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL1806291 0.84 ALDH1A1 (0.53) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL1805024 0.82 MAPK1 (0.55) ALDH1A1HSD17B10KDM4EHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6812324-B2 REACTING 5-SULFOISOPHTHALATE SALTS ESTER WITH ALIPHATIC DIAMINE TO A COMPOUND OF TERMINAL AMINE, 5-SULFOBENZENE DIAMIDE; REACTING CAPROLACTAM AND ALIPHATIC DIACID AND THEN ADDING THE AMINE TERMINAL 5-SULFOBENZENEDIAMIDE AND CATALYST INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2004-11-02 US claimed
US-20030130478-A1 Method for preparing nylon 6 copolymer containing sulfonate comonomers INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2003-07-10 US claimed
US-6812324-B2 REACTING 5-SULFOISOPHTHALATE SALTS ESTER WITH ALIPHATIC DIAMINE TO A COMPOUND OF TERMINAL AMINE, 5-SULFOBENZENE DIAMIDE; REACTING CAPROLACTAM AND ALIPHATIC DIACID AND THEN ADDING THE AMINE TERMINAL 5-SULFOBENZENEDIAMIDE AND CATALYST INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2004-11-02 US disclosed
US-6812324-B2 REACTING 5-SULFOISOPHTHALATE SALTS ESTER WITH ALIPHATIC DIAMINE TO A COMPOUND OF TERMINAL AMINE, 5-SULFOBENZENE DIAMIDE; REACTING CAPROLACTAM AND ALIPHATIC DIACID AND THEN ADDING THE AMINE TERMINAL 5-SULFOBENZENEDIAMIDE AND CATALYST INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2004-11-02 US disclosed
US-20030130478-A1 Method for preparing nylon 6 copolymer containing sulfonate comonomers INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2003-07-10 US disclosed
US-20030130478-A1 Method for preparing nylon 6 copolymer containing sulfonate comonomers INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2003-07-10 US disclosed