SCHEMBL4570685

SCHEMBL4570685

Cc1ccc2cc(OC=O)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.54
CYP1A2 P05177 3/20 0.54
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FLT3 P36888 2/20 0.38
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
RELA Q04206 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CBFB Q13951 1/20 0.35
ACHE P22303 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL8763499 0.87 CBFB (0.39) CYP2A6CYP1A2TDP1KDM4ECA9
SCHEMBL14876962 0.82 CYP1A2 (0.39) CYP2A6CYP1A2TDP1KDM4ECA9
SCHEMBL1587526 0.81 CYP2A6 (0.56) CYP2A6CYP1A2ALDH1A1KDM4EHPGD
SCHEMBL95902 0.80 ACHE (0.48) CYP2A6TDP1ALDH1A1KDM4ELMNA
SCHEMBL97419 0.78 CYP1A2 (0.52) CYP2A6CYP1A2TDP1KDM4EGAA
SCHEMBL28837871 0.78 ACHE (0.46) CYP2A6TDP1ALDH1A1KDM4ELMNA
SCHEMBL28764686 0.78 CYP1A2 (0.57) CYP2A6CYP1A2ALDH1A1KDM4ECBFB
SCHEMBL27905015 0.77 ALDH1A1 (0.43) CYP2A6CYP1A2ALDH1A1KDM4EGAA
SCHEMBL19213936 0.77 NQO2 (0.46) CYP1A2TDP1ALDH1A1KDM4ELMNA
SCHEMBL19897083 0.77 CYP1A2 (0.45) CYP2A6CYP1A2TDP1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117756623-A Preparation method of 2, 6-naphthalene dicarboxylic acid 安徽英特美科技有限公司 2024-03-26 CN claimed
CN-115722157-B Reaction system and method for preparing 2, 6-naphthalene dicarboxylic acid by oxidizing 2, 6-diisopropyl naphthalene 中国石油化工股份有限公司 2025-05-30 CN disclosed
CN-115722157-B Reaction system and method for preparing 2, 6-naphthalene dicarboxylic acid by oxidizing 2, 6-diisopropyl naphthalene 中国石油化工股份有限公司 2025-05-30 CN disclosed
CN-120037675-A Device and method for preparing 2, 6-naphthalene dicarboxylic acid 煤炭科学技术研究院有限公司 2025-05-27 CN disclosed
CN-118702570-A Method for preparing 2, 6-dimethyl naphthalene dicarboxylate 安徽泰达新材料股份有限公司 2024-09-27 CN disclosed
CN-117843471-A Method for purifying 2, 6-naphthalene dicarboxylic acid 中国石油化工股份有限公司 2024-04-09 CN disclosed
CN-117756623-A Preparation method of 2, 6-naphthalene dicarboxylic acid 安徽英特美科技有限公司 2024-03-26 CN disclosed
CN-117756623-A Preparation method of 2, 6-naphthalene dicarboxylic acid 安徽英特美科技有限公司 2024-03-26 CN disclosed
CN-117430504-A Reaction mixture for preparing 2, 6-naphthalene dicarboxylic acid, crude 2, 6-naphthalene dicarboxylic acid, product and preparation method thereof 中国石油化工股份有限公司 2024-01-23 CN disclosed
CN-114773192-B Method for continuously preparing 2, 6-dimethyl naphthalene dicarboxylate slices 煤炭科学技术研究院有限公司 2023-09-26 CN disclosed
US-11649332-B2 Method of processing liquid crystal polymer film AZOTEK CO., LTD. (TW) 2023-05-16 US disclosed
EP-3112440-B1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2019-07-24 EP disclosed
US-20180094155-A1 INKJET INK AND COLORING COMPOSITION RICOH COMPANY, LTD. (JP) 2018-04-05 US disclosed
US-9340743-B2 Metallurgical lubricant powder and metal powder composition IDEMITSU KOSAN CO., LTD. (JP) 2016-05-17 US disclosed
US-8940392-B2 Titanium based inorganic-organic hybrid solid material, method for preparing same and uses thereof UNIVERSITE PIERRE ET MARIE CURIE (PARIS 6) (FR) 2015-01-27 US disclosed
US-20130068069-A1 METALLURGICAL LUBRICANT POWDER AND METAL POWDER COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2013-03-21 US disclosed
US-20120121904-A1 TITANIUM BASED INORGANIC-ORGANIC HYBRID SOLID MATERIAL, METHOD FOR PREPARING SAME AND USES THEREOF L'UNIVERSITE PIERRE ET MARIE CURIE, (PARIS 6) (FR) 2012-05-17 US disclosed
CN-1142900-C Technology for producing aromatic carboxylic acid ������ѧ��ʽ���� 2004-03-24 CN disclosed