SCHEMBL54682

SCHEMBL54682

CC(=O)c1ccc(C(C)=O)o1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 4/20 0.43
GLA P06280 4/20 0.43
GAA P10253 3/20 0.43
HSD17B10 Q99714 3/20 0.43
LMNA P02545 3/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CASP1 P29466 1/20 0.43
BRCA1 P38398 1/20 0.43
CASP7 P55210 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
MAPT P10636 4/20 0.42
MEN1 O00255 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42

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
SCHEMBL6239663 0.89 TDP1 (0.50) KMT2AALDH1A1KDM4EGAAHSD17B10
SCHEMBL9375831 0.87 ALDH1A1 (0.46) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL3063658 0.87 KMT2A (0.38) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL14495734 0.87 MAPT (0.41) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL12140121 0.86 ALDH1A1 (0.54) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL22845659 0.85 KMT2A (0.44) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL18403916 0.85 KMT2A (0.41) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL528109 0.84
SCHEMBL183532 0.84
SCHEMBL10544541 0.83 SMN1; SMN2 (0.43) KMT2AALDH1A1KDM4EGLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117362252-B Method for preparing 2, 5-dimethyl furandicarboxylate from furan 华东师范大学 2024-09-10 CN claimed
CN-117362252-A Method for preparing 2, 5-dimethyl furandicarboxylate from furan 华东师范大学 2024-01-09 CN claimed
EP-3231795-B1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND NINGBO INST MATERIALS TECH & ENG CAS (CN) 2021-09-15 EP claimed
CN-112321545-A Preparation method of 2, 5-diacetylfuran 中国科学院宁波材料技术与工程研究所 2021-02-05 CN claimed
US-10125110-B2 Method for preparing 2,5-disubstituted furan compound NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2018-11-13 US claimed
CN-105753821-B A kind of preparation method of 2,5- furandicarboxylic acids 中国科学院宁波材料技术与工程研究所 2018-11-02 CN claimed
US-20170320844-A1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2017-11-09 US claimed
EP-3231795-A1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND Ningbo Institute Of Material Technology And Engineering Chinese Academy of Sciences (CN) 2017-10-18 EP claimed
CN-105753821-A Preparation method of 2,5-furandicarboxylic acid 中国科学院宁波材料技术与工程研究所 2016-07-13 CN claimed
CN-105732546-A Preparation method of 2, 5-diacyl furan compound 中国科学院宁波材料技术与工程研究所 2016-07-06 CN claimed
CN-105732545-A Preparation method of 2, 5-diacyl furan compound 中国科学院宁波材料技术与工程研究所 2016-07-06 CN claimed
CN-117362252-B Method for preparing 2, 5-dimethyl furandicarboxylate from furan 华东师范大学 2024-09-10 CN disclosed
CN-117362252-B Method for preparing 2, 5-dimethyl furandicarboxylate from furan 华东师范大学 2024-09-10 CN disclosed
CN-115850216-B Stable isotope labeled 2, 5-furandicarboxylic acid-2-13Method for synthesizing COOH 上海化工研究院有限公司 2024-05-28 CN disclosed
CN-117362252-A Method for preparing 2, 5-dimethyl furandicarboxylate from furan 华东师范大学 2024-01-09 CN disclosed
WO-2007071396-A2 PYRAZINOYLGUANIDINE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2007-06-28 WO disclosed
US-20060078351-A1 Organophotoreceptors with a charge transport material having multiple vinyl-containing hydrazone groups S-PRINTING SOLUTION CO., LTD. (KR) 2006-04-13 US disclosed
EP-0804142-B1 DIKETO COMPOUNDS FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL KGAA (DE) 1999-03-17 EP disclosed
EP-0804142-A1 DIKETO COMPOUNDS FOR COLOURING KERATIN-CONTAINING FIBRES Henkel Kommanditgesellschaft auf Aktien (DE) 1997-11-05 EP disclosed
WO-1996022076-A1 DIKETO COMPOUNDS FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1996-07-25 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 (3 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-20170320844-A1 METHOD FOR PREPARING 2,5-DISUBSTITUTED FURAN COMPOUND ALOX5, PFAS, APEH KMT2A 601/4885ALDH1A1 561/4885KDM4E 211/4885
US-10125110-B2 Method for preparing 2,5-disubstituted furan compound ALOX5, PFAS, APEH KMT2A 601/4885ALDH1A1 561/4885KDM4E 211/4885
US-20060078351-A1 Organophotoreceptors with a charge transport material having multiple vinyl-containing hydrazone groups SLC16A7, SLC16A1, SLC16A3 KMT2A 2663/4885ALDH1A1 695/4885KDM4E 2185/4885

“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.