SCHEMBL8190992

SCHEMBL8190992

CC(=O)c1cc(N)ccc1S(N)(=O)=O.[Na]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 3/20 0.43
CYP3A4 P08684 3/20 0.43
KMT2A Q03164 3/20 0.43
THRB P10828 2/20 0.43
RECQL P46063 2/20 0.43
CYP2C19 P33261 2/20 0.43
TNF P01375 1/20 0.43
HSPD1 P10809 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP1 P29466 1/20 0.43
PTGS2 P35354 1/20 0.43
KDR P35968 1/20 0.43
BRCA1 P38398 1/20 0.43
CASP7 P55210 1/20 0.43
HSPE1 P61604 1/20 0.43

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
SCHEMBL4638644 0.98 ALDH1A1 (0.44) TDP1ALDH1A1KDM4EMEN1CYP3A4
Quinoxaline SCHEMBL10762474 0.84 CA1 (0.39) TDP1ALDH1A1KDM4EMEN1CYP3A4
SCHEMBL10612152 0.84 ALDH1A1 (0.46) TDP1ALDH1A1KDM4EMEN1CYP3A4
SCHEMBL9713812 0.83 PKM (0.49) TDP1ALDH1A1KDM4EMEN1CYP3A4
Lithium SCHEMBL29868510 0.82 ALDH1A1 (0.45) TDP1ALDH1A1KDM4EMEN1CYP3A4
Ammonia Solution, Strong SCHEMBL11761732 0.82 ALDH1A1 (0.45) TDP1ALDH1A1KDM4EMEN1CYP3A4
SCHEMBL27484633 0.82 ALDH1A1 (0.45) TDP1ALDH1A1KDM4EMEN1CYP3A4
SCHEMBL4349616 0.82 L3MBTL1 (0.42) TDP1ALDH1A1KDM4EMEN1CYP3A4
SCHEMBL28603286 0.82 ALDH1A1 (0.45) TDP1ALDH1A1KDM4EMEN1CYP3A4
SCHEMBL1744678 0.81 CA2 (0.49) TDP1ALDH1A1KDM4EMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119343126-A Skin barrier protection delivery system and method thereof 宝宝实验室公司 2025-01-21 CN disclosed
EP-0797635-B1 NON-AQUEOUS INKS AND COATINGS CONTAINING CARBON PRODUCTS CABOT CORP (US) 2000-02-16 EP disclosed
US-5713988-A LABELS FOR CARDBOARD BOXES, METAL OR PLASTIC CONTAINERS CABOT CORPORATION (US) 1998-02-03 US disclosed
EP-0797635-A2 NON-AQUEOUS INKS AND COATINGS CONTAINING CARBON PRODUCTS CABOT CORPORATION (US) 1997-10-01 EP disclosed
WO-1996018694-A2 NON-AQUEOUS INKS AND COATINGS CONTAINING CARBON PRODUCTS CABOT CORPORATION (US) 1996-06-20 WO disclosed