SCHEMBL8913381

SCHEMBL8913381

O=S(=O)(Cc1ccccc1)OCCc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
KMT2A Q03164 5/20 0.46
MEN1 O00255 3/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
FKBP1A P62942 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
TAAR1 Q96RJ0 2/20 0.40
PRMT1 Q99873 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 1/20 0.39
PLAAT4 Q9UL19 1/20 0.39

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
SCHEMBL6912270 0.90 CA1 (0.63) CA1CA2CA9KMT2AHTT
SCHEMBL9309031 0.80 KMT2A (0.61) CA1CA2CA9KMT2AHTT
SCHEMBL18045536 0.80 HTT (0.62) CA1CA2CA9KMT2AMEN1
SCHEMBL16394862 0.80 KMT2A (0.52) CA1CA2CA9KMT2AHTT
SCHEMBL2762566 0.78 KMT2A (0.53) CA1CA2CA9KMT2AHTT
SCHEMBL7619550 0.77 KMT2A (0.57) CA1CA2CA9KMT2AHTT
SCHEMBL27441779 0.76 KMT2A (0.45) CA1CA2CA9KMT2AHTT
SCHEMBL11441693 0.75 CA1 (0.63) CA1CA2CA9KMT2AMEN1
SCHEMBL10880837 0.75 CA1 (0.44) CA1CA2CA9KMT2AMEN1
SCHEMBL28377908 0.74 L3MBTL1 (0.44) KMT2AMEN1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35462-E Silylated benzoic acid derivatives CONSORTIUM FUR ELEKOCHEMISCHE IND. GMBH (DE) 1997-02-25 US disclosed
US-5277838-A Silylated benzoic acid derivatives CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1994-01-11 US disclosed
US-5106530-A Liquid crystals Consortium Fur Elektrochemische Ind. (DE) 1992-04-21 US disclosed
EP-0424959-A2 Organosilylalkyl-aromatic compounds Consortium für elektrochemische Industrie GmbH (DE) 1991-05-02 EP disclosed