SCHEMBL7793142

SCHEMBL7793142

Nc1ccc(CS(=O)(=O)O)c(N)c1.Nc1ccc(Oc2ccc(N)c(S(=O)(=O)O)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.40
ALDH1A1 P00352 7/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 1/20 0.40
MITF O75030 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
GFER P55789 1/20 0.40
KMT2A Q03164 1/20 0.40
NLRP1 Q9C000 1/20 0.40
NOD2 Q9HC29 1/20 0.40
RAPGEF4 Q8WZA2 1/20 0.35
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PARP10 Q53GL7 1/20 0.34
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL11311935 0.85 ALDH1A1 (0.48) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
Ammonia Solution, Strong SCHEMBL7554725 0.84 ALDH1A1 (0.47) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
Trimethylammonium SCHEMBL7551112 0.80 CTDSP1 (0.46) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
SCHEMBL31184488 0.79 CTDSP1 (0.51) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
SCHEMBL3871858 0.79 CTDSP1 (0.51) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
SCHEMBL190799 0.79 TSHR (0.46) ALDH1A1MEN1GAAMAPTKMT2A
SCHEMBL7554818 0.78 CTDSP1 (0.48) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
SCHEMBL8747802 0.75 SLC7A11 (0.51) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
SCHEMBL7555565 0.74 CTDSP1 (0.44) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF
SCHEMBL7549478 0.73 CTDSP1 (0.44) CTDSP1ALDH1A1SMN1; SMN2MEN1MITF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879255-B1 BINDING AGENTS FOR POLYURETHANE-BASED PAINTS BASF COATINGS AG (DE) 2001-11-21 EP disclosed
EP-0708788-B1 COATINGS BASED ON POLYURETHANE RESINS AND THEIR USE BASF COATINGS AG (DE) 2000-01-19 EP disclosed
EP-0740674-B1 POLYURETHANE RESINS, PROCESS FOR PRODUCING THEM AND THEIR USE IN WATER-DILUTABLE COATING AGENTS BASF COATINGS AG (DE) 1998-06-17 EP disclosed