SCHEMBL175602

SCHEMBL175602

O=C(O)CC(=O)Nc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.63
L3MBTL1 Q9Y468 2/20 0.62
KDM1A O60341 1/20 0.62
MAPT P10636 3/20 0.60
HTT P42858 1/20 0.59
TP53 P04637 1/20 0.58
EPHX1 P07099 1/20 0.58
TSHR P16473 1/20 0.58
CDK9 P50750 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
CLK4 Q9HAZ1 1/20 0.58
HDAC4 P56524 4/20 0.58
HDAC1 Q13547 4/20 0.58
HDAC7 Q8WUI4 4/20 0.58
HDAC11 Q96DB2 4/20 0.58
HDAC8 Q9BY41 4/20 0.58
HDAC6 Q9UBN7 4/20 0.58
HDAC9 Q9UKV0 4/20 0.58
HDAC5 Q9UQL6 4/20 0.58
HDAC3 O15379 3/20 0.58

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
SCHEMBL1689206 0.90 EPHX2 (0.68) EPHX2L3MBTL1KDM1AMAPTHTT
SCHEMBL9001575 0.89 EPHX2 (0.57) EPHX2L3MBTL1KDM1AMAPTHTT
SCHEMBL70039 0.87 ALDH1A1 (0.70) MAPTHTTTP53SMN1; SMN2HDAC4
SCHEMBL27538195 0.86 EPHX2 (0.63) EPHX2L3MBTL1KDM1AMAPTHTT
SCHEMBL9235727 0.84 HDAC4 (0.61) EPHX2L3MBTL1KDM1AMAPTHTT
SCHEMBL3342586 0.83 L3MBTL1 (0.80) EPHX2L3MBTL1MAPTHTTSMN1; SMN2
SCHEMBL13476524 0.82 MGLL (0.68) HDAC4HDAC1HDAC7HDAC11HDAC8
SCHEMBL3021545 0.82 MAPT (0.67) EPHX2L3MBTL1KDM1AMAPTHTT
SCHEMBL6832724 0.82 CYP1A1 (0.71) L3MBTL1MAPTTP53TSHRMAOB
SCHEMBL14964154 0.82 EPHX2 (0.59) EPHX2L3MBTL1KDM1AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114044742-B Chiral primary amine malonamide compound and preparation method and application thereof 河北工业大学 2023-02-10 CN claimed
CN-114044742-A Chiral primary amine malonamide compound and preparation method and application thereof 河北工业大学 2022-02-15 CN claimed
US-10364208-B2 Oxidative coupling of aryl boron reagents with SP3-carbon nucleophiles, and ambient decarboxylative arylation of malonate half-esters via oxidative catalysis THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2019-07-30 US claimed
US-20180186721-A1 OXIDATIVE COUPLING OF ARYL BORON REAGENTS WITH SP3-CARBON NUCLEOPHILES, AND AMBIENT DECARBOXYLATIVE ARYLATION OF MALONATE HALF-ESTERS VIA OXIDATIVE CATALYSIS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2018-07-05 US claimed
EP-0512211-B1 Process for the preparation of substituted malonic ester anilides and malonic acid monoanilides HUELS CHEMISCHE WERKE AG (DE) 1995-04-12 EP claimed
US-5144077-A PROCESS FOR WORKING UP THE CRYSTALLIZATION MOTHER LIQUOR FROM THE RESOLUTION OF THE RACEMATE OF 1-(4-CHLOROPHENYL)-ETHYLAMINE BAYER AKTIENGESELLSCHAFT (DE) 1992-09-01 US claimed
WO-1991015464-A1 AMIDE ESTER ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1991-10-17 WO claimed
CN-115160204-B Fibroblast activation protein inhibitor and preparation method and application thereof 山东大学 2024-04-09 CN disclosed
CN-116969904-A Compounds useful as autophagy modulators, methods of preparation and uses thereof 微境生物医药科技(上海)有限公司 2023-10-31 CN disclosed
US-20230321130-A1 Senolytic Compositions and Uses Thereof Rubedo Life Sciences, Inc. 2023-10-12 US disclosed
EP-3632903-B1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF WIGEN BIOMEDICINE TECH SHANGHAI CO LTD (CN) 2023-10-11 EP disclosed
CN-111148740-B Compounds useful as autophagy modulators, methods of preparation and uses thereof 微境生物医药科技(上海)有限公司 2023-08-25 CN disclosed
US-11603349-B2 Anti-fibrotic compounds CERTA THERAPEUTICS PTY LTD (AU) 2023-03-14 US disclosed
EP-0511003-A1 Superactive GRF analogs ELI LILLY AND COMPANY (US) 1992-10-28 EP disclosed
EP-0262209-B1 SYNERGISTIC PLANT GROWTH REGULATOR COMPOSITIONS RHONE POULENC BV (NL) 1992-08-05 EP disclosed
US-5123951-A Ethylene response inducing agent and malonic acid derivative RHONE-POULENC NEDERLAND B.V. (NL) 1992-06-23 US disclosed
US-4904787-A CYCLIZATION USING POLYPHOSPHORIC ACID; NONHYDROLIZING, ONE STEP MITSUBISHI KASEI CORPORATION (JP) 1990-02-27 US disclosed
EP-0335046-A1 Method for producing 2,4-dihydroxyquinoline derivatives MITSUBISHI KASEI CORPORATION (JP) 1989-10-04 EP disclosed
EP-0298040-A1 1,3-Dithiol-2-ylidene derivatives YUHAN CORPORATION, LTD. (KR) 1989-01-04 EP disclosed
EP-0101330-B1 2-QUINOLONE DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1988-08-24 EP 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 (4 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-11603349-B2 Anti-fibrotic compounds TGFB1, SMAD3, TGFB2 EPHX2 2366/4885L3MBTL1 4340/4885KDM1A 3973/4885
US-10364208-B2 Oxidative coupling of aryl boron reagents with SP3-carbon nucleophiles, and ambient decarboxylative arylation of malonate half-esters via oxidative catalysis SOD1, AOC3, CBR3 EPHX2 2857/4885L3MBTL1 2188/4885KDM1A 4041/4885
US-20230321130-A1 Senolytic Compositions and Uses Thereof SENP3, SENP6, SENP1 EPHX2 3688/4885L3MBTL1 1107/4885KDM1A 2701/4885
US-20180186721-A1 OXIDATIVE COUPLING OF ARYL BORON REAGENTS WITH SP3-CARBON NUCLEOPHILES, AND AMBIENT DECARBOXYLATIVE ARYLATION OF MALONATE HALF-ESTERS VIA OXIDATIVE CATALYSIS SOD1, AOC3, CBR3 EPHX2 2857/4885L3MBTL1 2188/4885KDM1A 4041/4885

“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.