SCHEMBL9822755

SCHEMBL9822755

O=S(=O)(Cl)c1ccc(Cl)cc1.c1ccc2c(c1)C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ CYP3A4 P08684 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.44
▸ PKM P14618 1/20 0.44
▸ PSEN1 P49768 3/20 0.44
▸ PSEN2 P49810 3/20 0.44
▸ APH1B Q8WW43 3/20 0.44
▸ NCSTN Q92542 3/20 0.44
▸ APH1A Q96BI3 3/20 0.44
▸ PSENEN Q9NZ42 3/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA3 P07451 1/20 0.43
▸ CA4 P22748 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
SCHEMBL67558 0.82 ALDH1A1 (0.65) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
SCHEMBL9822634 0.78 ALDH1A1 (0.45) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
SCHEMBL995084 0.76 ALDH1A1 (0.56) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
Chlorobenzene SCHEMBL7157332 0.76 ALDH1A1 (0.80) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
Diphenylether SCHEMBL4640253 0.73 PGR (0.64) ALDH1A1HSD17B10TDP1MEN1KMT2A
SCHEMBL8589523 0.72 ALDH1A1 (0.52) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
SCHEMBL651902 0.72 ALDH1A1 (0.71) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
SCHEMBL5564527 0.72 ALDH1A1 (0.52) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
SCHEMBL6896419 0.72 MAPT (0.47) ALDH1A1HSD17B10TDP1CYP3A4MAPK1
SCHEMBL6162025 0.72 KDM4E (0.54) ALDH1A1HSD17B10TDP1CYP3A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238401-B1 SULFON AMIDES DERIVED FROM DIARYL METHANES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATION CONTAINING THEM SANOFI (FR) 1991-08-14 — — EP claimed
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