SCHEMBL708079

SCHEMBL708079

O=C(O)c1ccc(C(=O)O)c(OC(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYGL P06737 1/20 0.49
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA7 P43166 1/20 0.46
TPMT P51580 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
USP2 O75604 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RAB9A P51151 2/20 0.43

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
SCHEMBL29940464 1.00 PYGL (0.49) PYGLRXRARXRBRXRGCA12
SCHEMBL3367612 0.85 RXRA (0.54) PYGLRXRARXRBRXRGCA12
SCHEMBL14213194 0.84 RXRA (0.49) PYGLRXRARXRBRXRGCA12
SCHEMBL1538085 0.83 CA12 (0.41) PYGLRXRARXRBRXRGCA12
SCHEMBL1110964 0.82 HTT (0.50) PYGLRXRARXRBRXRGCA12
SCHEMBL3648979 0.82 HTT (0.61) PYGLRXRARXRBRXRGCA12
SCHEMBL11816083 0.82 RXRA (0.48) PYGLRXRARXRBRXRGCA12
SCHEMBL17339467 0.82 PYGL (0.46) PYGLRXRARXRBRXRGCA1
SCHEMBL27051473 0.82 ESR1 (0.53) RXRARXRBRXRGCA12CA1
SCHEMBL6556756 0.81 HSD11B1 (0.48) PYGLALDH1A1USP2HPGDTSHR

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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117887086-A Application of halogen functionalized metal organic framework material in storage and delivery of fluorine-containing electron special gas 华为技术有限公司 2024-04-16 CN claimed
WO-2024074141-A1 POROUS MATERIAL AND APPLICATION THEREOF 华为技术有限公司 2024-04-11 WO claimed
CN-117013199-A Fluorinated MOFs-based diaphragm for dendrite-free lithium metal battery and preparation method thereof 广东工业大学 2023-11-07 CN claimed
CN-115947949-B Porous metal organic framework material and synthesis method thereof, adsorbent and method for purifying ethylene 深圳职业技术学院 2023-10-27 CN claimed
CN-116371473-A Composite catalyst for olefin epoxidation reaction, preparation method and application thereof 大连理工大学宁波研究院 2023-07-04 CN claimed
CN-115947949-A Porous metal organic framework material and synthesis method thereof, adsorbent and method for purifying ethylene 深圳职业技术学院 2023-04-11 CN claimed
CN-110145200-A A kind of automatic unit of belt-type Domestic door 宁波多泰自动门有限公司 2019-08-20 CN claimed
US-7880026-B2 preparing a reactant solution containing metal organic framework (MOF) precursors comprise Zn(NO3)2*6H2O and 4,4',4'',4'''-(21H,23H-porphine-5-10-15-20-tetrayl)tetrakis(benzoic acid), the reactant solution includes diethylformamide solvent, exposing to microwave to produce Zn-MOF crystal THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2011-02-01 US claimed
US-20100075123-A1 WATER REPELLENT METAL-ORGANIC FRAMEWORKS, PROCESS FOR MAKING AND USES REGARDING SAME University of Illinois - Office of Technology Management (US) 2010-03-25 US claimed
US-20090131643-A1 Rapid metal organic framework molecule synthesis method BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS, THE 2009-05-21 US claimed
EP-1948353-A2 HIGH GAIN SELECTIVE PRECONCENTRATORS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-07-30 EP claimed
WO-2008057140-A2 RAPID METAL ORGANIC FRAMEWORK MOLECULE SYNTHESIS METHOD THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-05-15 WO claimed
WO-2007044473-A2 HIGH GAIN SELECTIVE PRECONCENTRATORS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-04-19 WO claimed
US-12576055-B2 Disease detection and treatment based on trimethyl-lysine levels THE CLEVELAND CLINIC FOUNDATION (US) 2026-03-17 US disclosed
WO-2024243289-A2 GUT MICROBE DERIVED AROMATIC AMINO ACID METABOLITES FOR DETECTION AND TREATMENT OF DISEASE THE CLEVELAND CLINIC FOUNDATION (US) 2024-11-28 WO disclosed
CN-116371473-B Composite catalyst for olefin epoxidation reaction, preparation method and application thereof 大连理工大学宁波研究院 2024-07-09 CN disclosed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 US disclosed
WO-2002062778-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-15 WO disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO 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 (2 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-12576055-B2 Disease detection and treatment based on trimethyl-lysine levels BHMT, BHMT2, EHMT2 PYGL 1466/4885RXRA 4193/4885RXRB 3155/4885
US-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 PYGL 1466/4885RXRA 3874/4885RXRB 3475/4885

“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.