SCHEMBL7747515

SCHEMBL7747515

CCCCCCSN1C(=O)c2ccccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.49
NR1H3 Q13133 1/20 0.49
SOAT1 P35610 9/20 0.48
ASAH1 Q13510 1/20 0.48
CES1 P23141 2/20 0.46
CDC25A P30304 1/20 0.46
ALDH1A1 P00352 1/20 0.44
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44

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
SCHEMBL2426919 1.00 NR1H2 (0.49) NR1H2NR1H3SOAT1ASAH1CES1
SCHEMBL10930441 1.00 NR1H2 (0.49) NR1H2NR1H3SOAT1ASAH1CES1
SCHEMBL5847525 0.98 SOAT1 (0.46) NR1H2NR1H3SOAT1ASAH1CES1
SCHEMBL10351412 0.93 SOAT1 (0.45) NR1H2NR1H3SOAT1ASAH1CES1
SCHEMBL11803233 0.91 CYP1A2 (0.43) ALDH1A1
SCHEMBL10335606 0.85 DRD3 (0.44) NR1H2NR1H3SOAT1ALDH1A1
SCHEMBL11604125 0.78 CASP3 (0.41) CDC25AALDH1A1
SCHEMBL10351913 0.77 ALDH1A1 (0.43) SOAT1CDC25AALDH1A1
SCHEMBL11750426 0.77 NR1H2 (0.47) NR1H2NR1H3ASAH1CES1CDC25A
SCHEMBL11807791 0.77 NR1H2 (0.47) NR1H2NR1H3ASAH1CES1CDC25A

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-1086176-A1 LOW-EMISSION FLOOR COVERING DLW Aktiengesellschaft (DE) 2001-03-28 EP disclosed
WO-1999058602-A1 LOW-EMISSION FLOOR COVERING DLW AKTIENGESELLSCHAFT (DE) 1999-11-18 WO disclosed
US-4412062-A CURE RETARDERS; TETRAOXAPHOSPHASDIROUNDECANES, 4-HYDROXYBENZYL ISOCYANURATES, N-HYDROCARBYLTHIOPHTHALIMIDES AND TRIHYDROCARBYL TRITHIOPHOSPHITES PHILLIPS PETROLEUM COMPANY (US) 1983-10-25 US disclosed