SCHEMBL2932814

SCHEMBL2932814

O=C1CCc2cc(O)c(O)cc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.57
EGFR P00533 1/20 0.52
HSD17B1 P14061 4/20 0.50
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
PRKCI P41743 1/20 0.44
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ADCY6 O43306 1/20 0.39
ADCY3 O60266 1/20 0.39
ADCY9 O60503 1/20 0.39
ADCY5 O95622 1/20 0.39
ADCY8 P40145 1/20 0.39
ADCY7 P51828 1/20 0.39
ADCY2 Q08462 1/20 0.39

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
SCHEMBL9620738 0.86 MAOA (0.55) PBRM1EGFRHSD17B1MAOAMAOB
SCHEMBL423181 0.86 MAOA (0.60) PBRM1EGFRHSD17B1MAOAMAOB
SCHEMBL10102257 0.83 PBRM1 (0.50) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL1032102 0.83 PBRM1 (0.50) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL29033 0.83 HSD17B1 (0.60) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL25269929 0.83 HSD17B1 (0.60) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL2930139 0.83 PBRM1 (0.50) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL2304058 0.83 PBRM1 (0.50) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL1562728 0.83 PBRM1 (0.50) PBRM1EGFRHSD17B1CASP1CASP7
SCHEMBL9520543 0.83 PBRM1 (0.50) PBRM1EGFRHSD17B1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117186044-A Benzofuranone derivative and application thereof 中国科学院新疆理化技术研究所 2023-12-08 CN claimed
CN-105237383-A Indanone derivative 5,6-dyhydroxy-2,3-dihydrocaroone-1H-indene-1-ketone and preparation method thereof UNIV HEILONGJIANG 2016-01-13 CN claimed
CN-117229244-A Orange ketone analogue and application thereof 中国科学院新疆理化技术研究所 2023-12-15 CN disclosed
CN-117186044-A Benzofuranone derivative and application thereof 中国科学院新疆理化技术研究所 2023-12-08 CN disclosed
CN-105985265-B Indenes -1- subunit sulfonyl benzoyl hydrazine derivatives and its preparation method and application 四川大学 2018-11-13 CN disclosed
CN-103998422-B Cyclopentanedione oxime ester and application thereof 北京英力科技发展有限公司 2016-11-30 CN disclosed
CN-105985265-A Indene-1-subunit sulfonyl benzoyl hydrazine derivative as well as preparation method and application thereof 四川大学 2016-10-05 CN disclosed
CN-105237383-A Indanone derivative 5,6-dyhydroxy-2,3-dihydrocaroone-1H-indene-1-ketone and preparation method thereof UNIV HEILONGJIANG 2016-01-13 CN disclosed
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
WO-2015027702-A1 CYCLOPENTANEDIONE OXIME ESTER AND APPLICATION THEREOF 北京英力科技发展有限公司 (CN) 2015-03-05 WO disclosed
WO-2015027833-A1 CYCLOPENTADIONE OXIME ESTER AND APPLICATION THEREOF 北京英力科技发展有限公司 (CN) 2015-03-05 WO disclosed
WO-1993011258-A1 METHOD FOR ASSAYING THE SOD ACTIVITY BY USING A SELF-OXIDIZABLE COMPOUND NECESSARY FOR ITS IMPLEMENTATION, SELF-OXIDIZABLE COMPOUNDS AND PREPARATION THEREOF BIOXYTECH (FR) 1993-06-10 WO disclosed
US-5217999-A Antigrowth agents YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 1993-06-08 US disclosed
US-5198585-A Catalytic hydrogenation of arylisonitrosoalkanone HOECHST CELANESE CORPORATION (US) 1993-03-30 US disclosed
WO-1993001158-A1 METHOD FOR THE PREPARATION OF ARYLKETOAMINES HOECHST CELANESE CORPORATION (US) 1993-01-21 WO disclosed
US-5175368-A Hydrogenating aryl alpha-oximinoalkyl ketones in aqueous medium containing hydrochlroic acid, recovering salt HOECHST CELANESE CORPORATION (US) 1992-12-29 US disclosed
EP-0491557-A1 Process for the preparation of arylalkylamines and substituted arylalkylamines HOECHST CELANESE CORPORATION (US) 1992-06-24 EP disclosed
EP-0481705-A1 Process for the preparation of arylalkylamines and substituted arylalkylamines HOECHST CELANESE CORPORATION (US) 1992-04-22 EP disclosed
WO-1991016892-A1 STYRYL COMPOUNDS WHICH INHIBIT EGF RECEPTOR PROTEIN TYROSINE KINASE RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-11-14 WO disclosed
US-5041669-A Reacting alkyl aryl ketones with alkyl nitrites, extracting product, catalytically hydrogenating/reducing in nonaqueous acid mixture HOECHST CELANESE CORPORATION (US) 1991-08-20 US disclosed