SCHEMBL7153996

SCHEMBL7153996

CCCCCS(=O)(=O)c1ccc(O)c(O)c1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 5/20 0.63
THRB P10828 6/20 0.47
THRA P10827 1/20 0.47
CA2 P00918 4/20 0.45
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7442400 0.95 SERPINE1 (0.60) SERPINE1THRBTHRACA2ALDH1A1
SCHEMBL10673351 0.82 PPARA (0.61) SERPINE1THRBTHRA
SCHEMBL1129732 0.82 KAT8 (0.61) SERPINE1THRBTHRACA2ALDH1A1
SCHEMBL10347259 0.82 KAT8 (0.61) SERPINE1THRBTHRACA2ALDH1A1
SCHEMBL1347874 0.80 THRA (0.54) THRBTHRACA2ALDH1A1CYP3A4
SCHEMBL7070254 0.80 CA2 (0.56) SERPINE1THRBTHRACA2ALDH1A1
SCHEMBL9360020 0.80 SERPINE1 (0.46) SERPINE1THRBTHRACA2ALDH1A1
SCHEMBL9555081 0.79 TRPV1 (0.48) SERPINE1THRBTHRACYP3A4CYP2C9
SCHEMBL15682789 0.79 SERPINE1 (0.81) SERPINE1CA2SMN1; SMN2
SCHEMBL13286957 0.79 SERPINE1 (0.97) SERPINE1SMN1; SMN2

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
EP-0903625-B1 Thermographic recording materials AGFA GEVAERT (BE) 2003-05-14 EP claimed
US-6093528-A BLACK AND WHITE LIGHT-INSENSITIVE THERMOGRAPHIC RECORDING MATERIALS COMPRISING INSENSITIVE ORGANIC SILVER SALT AND 1,2-DIHYDROXYPHENYL REDUCING AGENT; IMPROVED PHOTOSTABILITY, ARCHIVABILITY, COLOR NEUTRALITY AND PRINT AGFA-GEVAERT (BE) 2000-07-25 US claimed
EP-0903625-A1 Novel reducing agents for use in thermographic recording materials AGFA-GEVAERT N.V. (BE) 1999-03-24 EP claimed
EP-0903625-B1 Thermographic recording materials AGFA GEVAERT (BE) 2003-05-14 EP disclosed
US-6093528-A BLACK AND WHITE LIGHT-INSENSITIVE THERMOGRAPHIC RECORDING MATERIALS COMPRISING INSENSITIVE ORGANIC SILVER SALT AND 1,2-DIHYDROXYPHENYL REDUCING AGENT; IMPROVED PHOTOSTABILITY, ARCHIVABILITY, COLOR NEUTRALITY AND PRINT AGFA-GEVAERT (BE) 2000-07-25 US disclosed
EP-0903625-A1 Novel reducing agents for use in thermographic recording materials AGFA-GEVAERT N.V. (BE) 1999-03-24 EP disclosed