SCHEMBL1260796

SCHEMBL1260796

O=C(O)CC1CC(C(=O)O)C(C(=O)O)C1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC6A12 P48065 3/20 0.46
▸ SLC6A11 P48066 3/20 0.46
▸ SLC6A13 Q9NSD5 3/20 0.46
▸ GABRR1 P24046 5/20 0.45
▸ GABRR2 P28476 1/20 0.45
▸ HSD11B1 P28845 1/20 0.43
▸ SLC1A2 P43004 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ TSHR P16473 1/20 0.33

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
SCHEMBL16249750 0.81 SLC6A12 (0.54) SLC6A12SLC6A11SLC6A13GABRR1GABRR2
SCHEMBL377179 0.81 GABRR1 (0.58) SLC6A12SLC6A11SLC6A13GABRR1GABRR2
SCHEMBL25660411 0.81 GABRR1 (0.58) SLC6A12SLC6A11SLC6A13GABRR1GABRR2
SCHEMBL25660412 0.81 GABRR1 (0.58) SLC6A12SLC6A11SLC6A13GABRR1GABRR2
SCHEMBL4754585 0.76 GABRR1 (0.36) GABRR1GABRR2
SCHEMBL143951 0.76 HSD11B1 (0.50) SLC6A12SLC6A11SLC6A13GABRR1GABRR2
SCHEMBL8628131 0.75 GABRR1 (0.50) GABRR1GABRR2SLC1A2MEN1CYP1A2
SCHEMBL2697233 0.75 GABRR1 (0.50) GABRR1GABRR2SLC1A2MEN1CYP1A2
SCHEMBL22039 0.75 GABRR1 (0.50) GABRR1GABRR2SLC1A2MEN1CYP1A2
SCHEMBL9782991 0.75 GABRR1 (0.50) GABRR1GABRR2SLC1A2MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6746730-B1 VARNISH COMPOSITION WHICH COMPRISES POLYMER COMPONENT CONTAINING TWO DIFFERENT POLYAMIC ACIDS, SOLUBLE POLYIMIDE, AND SOLVENT FOR DISSOLVING POLYMER COMPONENT CHISSO CORPORATION (JP) 2004-06-08 — — US claimed
US-5244985-A Epoxidized polyesters and method of production thereof NEW JAPAN CHEMICAL CO., LTD. (JP) 1993-09-14 — — US claimed
JP-59170117-A — — None — — JP disclosed
WO-2019176276-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL ELEMENT JSR株式会社 2019-09-19 — — WO disclosed
US-7880038-B2 complexing a tungsten boride and molybdenum boride, a phosphate compound, Mo and W metal, hydrogen peroxide and an amine oxide to form a catalyst, reacting an olefin with H2O2 in the pH 0 to 2 or more, in presence of above catalyst to produce carbonyl compounds by oxidative breaking of C-C bond of olefin SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-02-01 — — US disclosed
EP-1618953-B1 USE OF A METAL CATALYST SUMITOMO CHEMICAL CO (JP) 2010-12-08 — — EP disclosed
WO-2010011134-A2 OZONOLYSIS OF AROMATICS AND/OR OLEFINS DISHMAN PHARMACEUTICALS AND CHEMICALS LTD. (IN) 2010-01-28 — — WO disclosed
EP-1928936-A1 PROCESS FOR IMPROVING THE FLOW PROPERTIES OF POLYMER MELTS Ciba Holding Inc. (CH) 2008-06-11 — — EP disclosed
WO-2007039471-A1 PROCESS FOR IMPROVING THE FLOW PROPERTIES OF POLYMER MELTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-04-12 — — WO disclosed
US-20060211891-A1 Metal catalyst and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-21 — — US disclosed
EP-1618953-A1 METAL CATALYST AND ITS USE Sumitomo Chemical Company, Limited (JP) 2006-01-25 — — EP disclosed
EP-1188735-B1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL CO (JP) 2005-07-27 — — EP disclosed
US-20040152592-A1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL COMPANY, LIMTED 2004-08-05 — — US disclosed
US-6746730-B1 VARNISH COMPOSITION WHICH COMPRISES POLYMER COMPONENT CONTAINING TWO DIFFERENT POLYAMIC ACIDS, SOLUBLE POLYIMIDE, AND SOLVENT FOR DISSOLVING POLYMER COMPONENT CHISSO CORPORATION (JP) 2004-06-08 — — US disclosed
US-6703528-B2 CATALYTIC OXIDATION OF OLEFIN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-09 — — US disclosed
EP-1188735-A1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-20 — — EP disclosed
US-20020025906-A1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-28 — — US disclosed
US-6200655-B1 MULTILAYER; OPTICAL ELEMENT, POLYIMIDE ALIGNMENT LAYER; LIQUID CRYSTAL ELSICON, INC. 2001-03-13 — — US disclosed
US-5244985-A Epoxidized polyesters and method of production thereof NEW JAPAN CHEMICAL CO., LTD. (JP) 1993-09-14 — — US disclosed
JP-S59170117-A EPOXY RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO LTD 1984-09-26 — — JP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060211891-A1 Metal catalyst and its use SOD1, NOX4, MVD SLC6A12 1922/4885SLC6A11 3313/4885SLC6A13 3287/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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