SCHEMBL4192887

SCHEMBL4192887

Cc1cc(S(=O)(=O)c2cc(-c3ccccc3)c(O)c(C)c2-c2ccccc2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.46
GAA P10253 2/20 0.43
ALDH1A1 P00352 2/20 0.43
PKM P14618 1/20 0.43
ESR2 Q92731 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
PDE4B Q07343 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ATM Q13315 2/20 0.38
PABPC1 P11940 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
POLB P06746 1/20 0.38
GFER P55789 1/20 0.38
LOXL2 Q9Y4K0 2/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
MAOA P21397 1/20 0.37
LOX P28300 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 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
SCHEMBL14760441 0.78 ESR1 (0.53) ESR1GAAALDH1A1PKMESR2
SCHEMBL4344783 0.74 HSD17B1 (0.45) ESR1ALDH1A1ESR2PDE4B
SCHEMBL9460744 0.73 POLB (0.59) ESR1GAAALDH1A1PKMESR2
SCHEMBL13695492 0.72 GAA (0.54) ESR1GAAALDH1A1PKMMEN1
SCHEMBL29599083 0.71 GAA (0.58) ESR1GAAALDH1A1PKMESR2
SCHEMBL69907 0.71 GAA (0.58) ESR1GAAALDH1A1PKMESR2
SCHEMBL16201694 0.70 GAA (0.55) ESR1GAAALDH1A1PKMESR2
SCHEMBL9460461 0.70 HSD17B1 (0.39) ESR1GAAALDH1A1PKMESR2
SCHEMBL1070330 0.68 BACE1 (0.56) ESR1GAAALDH1A1MEN1KMT2A
SCHEMBL9713722 0.68 BACE1 (0.56) ESR1GAAALDH1A1MEN1KMT2A

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
EP-1279692-B1 OPTICAL PARTS AND SULFUR-CONTAINING POLY(THIO)ESTER (CO)POLYMER MITSUI CHEMICALS INC (JP) 2009-02-18 EP disclosed
US-7008571-B2 Optical component and sulfur-containing poly(thio)ester (co)polymer MITSUI CHEMICALS, INC. (JP) 2006-03-07 US disclosed
US-20030204030-A1 Optical parts and sulfur-containing poly (thio)ester (co)polymer MITSUI CHEMICALS, INC. (JP) 2003-10-30 US disclosed
EP-1279692-A1 OPTICAL PARTS AND SULFUR-CONTAINING POLY(THIO)ESTER (CO)POLYMER Mitsui Chemicals, Inc. (JP) 2003-01-29 EP disclosed