SCHEMBL9828049

SCHEMBL9828049

O=C(Cl)c1ccc(C(=O)Cl)c(S(=O)(=O)O)c1C(=O)Cl

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
ALOX15 P16050 1/20 0.33
CYP2D6 P10635 1/20 0.31

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
SCHEMBL8747639 0.88 ALDH1A1 (0.33) ALDH1A1ALOX15CYP2D6
SCHEMBL8904804 0.77 ALDH1A1 (0.48) ALDH1A1ALOX15
SCHEMBL11199579 0.72 ALDH1A1 (0.47) ALDH1A1ALOX15
SCHEMBL8747597 0.72 ALDH1A1 (0.42) ALDH1A1ALOX15
SCHEMBL893277 0.67 ALDH1A1 (0.56) ALDH1A1ALOX15
SCHEMBL28540780 0.67 THRB (0.39) ALDH1A1ALOX15
SCHEMBL9197331 0.65 ALDH1A1 (0.45) ALDH1A1ALOX15
SCHEMBL9197919 0.65 ALDH1A1 (0.48) ALDH1A1ALOX15
SCHEMBL890520 0.64 CDC25B (0.34) ALDH1A1ALOX15
SCHEMBL628149 0.64 ALDH1A1 (0.42) ALDH1A1ALOX15

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-0236592-B1 BRANCHED POLYCARBONATES CONTAINING SINGLE-RING AROMATIC COMPOUNDS MONTEDIPE S.r.l. (IT) 1991-10-16 EP claimed
US-4786707-A Branched polycarbonate derived from single-ring aromatic compound ENICHEM TECNORESINE S.P.A. (IT) 1988-11-22 US claimed
EP-0236592-A2 Branched polycarbonates containing single-ring aromatic compounds MONTEDIPE S.r.l. (IT) 1987-09-16 EP claimed
EP-0236592-B1 BRANCHED POLYCARBONATES CONTAINING SINGLE-RING AROMATIC COMPOUNDS MONTEDIPE S.r.l. (IT) 1991-10-16 EP disclosed
US-4786707-A Branched polycarbonate derived from single-ring aromatic compound ENICHEM TECNORESINE S.P.A. (IT) 1988-11-22 US disclosed
EP-0236592-A2 Branched polycarbonates containing single-ring aromatic compounds MONTEDIPE S.r.l. (IT) 1987-09-16 EP disclosed