SCHEMBL9822643

SCHEMBL9822643

C1=CC2=CC=C1C2.O=S(=O)(Cl)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MMP2 P08253 1/20 0.44
PGR P06401 5/20 0.41
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PKM P14618 1/20 0.37
AKR1B1 P15121 1/20 0.37
FBP1 P09467 1/20 0.37
NFE2L2 Q16236 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CTSG P08311 1/20 0.37
CMA1 P23946 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL29422524 0.84 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AMMP2PGR
SCHEMBL16000 0.84 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AMMP2PGR
SCHEMBL9822669 0.78 MMP2 (0.45) ALDH1A1MEN1KMT2AMMP2PGR
SCHEMBL5564527 0.77 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AMMP2PGR
Hydrochloric Acid SCHEMBL7571169 0.77 FBP1 (0.47) ALDH1A1MEN1KMT2AMMP2PGR
Acetone SCHEMBL27589640 0.74 MEP1B (0.42) ALDH1A1PGRPKMNFE2L2
SCHEMBL56599 0.71 ALDH1A1 (0.65) ALDH1A1MEN1KMT2APGRHSD17B10
SCHEMBL31435391 0.69 AKR1B1 (0.56) ALDH1A1MEN1KMT2AMMP2PGR
SCHEMBL2199161 0.69 AKR1B1 (0.56) ALDH1A1MEN1KMT2AMMP2PGR
SCHEMBL10726996 0.68 ALDH1A1 (0.86) ALDH1A1MEN1KMT2AMMP2PKM

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