SCHEMBL10694219

SCHEMBL10694219

O=S(=O)(c1ccccc1)c1ccccc1Oc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.56
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 1/20 0.43
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RECQL P46063 1/20 0.41
PGR P06401 1/20 0.41
SCN9A Q15858 1/20 0.40
FEN1 P39748 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40

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
Biphenyl SCHEMBL28423764 0.81 HTR6 (0.65) HTR6KDM4EKMT2A
SCHEMBL3249669 0.81 HTR6 (0.73) HTR6CA1CA2CA9KDM4E
SCHEMBL9323437 0.78 HTR6 (0.65) HTR6PGRKMT2A
Sulfuric Acid SCHEMBL1995909 0.77 ALDH1A1 (0.50) CA1CA2CA9KDM4EALDH1A1
Sulfuric Acid SCHEMBL30659034 0.77 ALDH1A1 (0.50) CA1CA2CA9KDM4EALDH1A1
SCHEMBL7187841 0.77 HTR6 (0.64) HTR6ALDH1A1HPGDKMT2AMEN1
SCHEMBL10342789 0.77 HTR6 (0.65) HTR6CA1CA2CA9KDM4E
SCHEMBL10537928 0.77 MMP1 (0.49) HTR6KDM4EALDH1A1HPGDTDP1
SCHEMBL442767 0.76 HTR1B (0.54) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL29577853 0.76 HTR1B (0.54) KDM4EALDH1A1HSD17B10HPGDTDP1

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-0282096-A2 Poly(dinaphthyl arylene ether)and preparation thereof THE B.F. GOODRICH COMPANY (US) 1988-09-14 EP disclosed