SCHEMBL9812652

SCHEMBL9812652

COC=C(C(=O)O)c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
CA12 O43570 4/20 0.48
CA7 P43166 4/20 0.48
CA9 Q16790 4/20 0.48
CA14 Q9ULX7 4/20 0.48
MAPT P10636 5/20 0.48
ESR1 P03372 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 2/20 0.48
MEN1 O00255 2/20 0.48
NR3C1 P04150 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
GAA P10253 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
ALOX15 P16050 1/20 0.48

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
SCHEMBL8635962 0.85 TDP1 (0.48) MAPTKMT2ALMNAMEN1GAA
SCHEMBL8958591 0.85 TDP1 (0.48) MAPTKMT2ALMNAMEN1GAA
SCHEMBL1996920 0.84 AKR1C1 (0.53) CA1CA2CA12CA9KMT2A
SCHEMBL2407093 0.84 AKR1C1 (0.53) CA1CA2CA12CA9KMT2A
SCHEMBL1996915 0.84 AKR1C1 (0.53) CA1CA2CA12CA9KMT2A
SCHEMBL8958964 0.83 HTT (0.50) CA1CA2MAPTKMT2AMEN1
SCHEMBL8958715 0.83 TPMT (0.47) CA1CA2KMT2AMEN1ALDH1A1
SCHEMBL7168869 0.83 AKR1C3 (0.50) CA1CA2MAPTCYP1A2ALOX15
SCHEMBL8958673 0.83 AKR1C3 (0.49) CA1CA2MAPTKMT2ALMNA
SCHEMBL8958971 0.83 HTT (0.50) CA1CA2MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605764-A Carrier composition for inorganic fine particle dispersion, inorganic fine particle dispersion slurry composition, and method for producing inorganic fine particle dispersible tablet 积水化学工业株式会社 2022-06-10 CN disclosed
CN-112585212-B Carrier composition for inorganic fine particle dispersion, inorganic fine particle dispersion slurry composition, and method for producing inorganic fine particle dispersible tablet 积水化学工业株式会社 2022-04-19 CN disclosed
CN-109970542-B Application of quebrachitol in copper-catalyzed aryl halide hydrolysis reaction 沈阳药科大学 2021-06-11 CN disclosed
CN-112585212-A Carrier composition for inorganic fine particle dispersion, inorganic fine particle dispersion slurry composition, and method for producing inorganic fine particle dispersible tablet 积水化学工业株式会社 2021-03-30 CN disclosed
EP-0155652-B2 PHOTOPOLYMERIZABLE MIXTURE AND RECORDING MATERIAL PRODUCED FROM IT E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-10 EP disclosed
EP-0155652-B1 PHOTOPOLYMERIZABLE MIXTURE AND RECORDING MATERIAL PRODUCED FROM IT E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-01-07 EP disclosed
US-4604342-A BINDER, PHOTOINITIATOR, AND ETHYLENICALLY UNSATURATED MONOMER E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-08-05 US disclosed
EP-0155652-A2 Photopolymerizable mixture and recording material produced from it E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-09-25 EP disclosed