SCHEMBL600593

SCHEMBL600593

NC=C(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.48
CYP11B2 P19099 2/20 0.48
TDP1 Q9NUW8 3/20 0.43
CYP2C19 P33261 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
BLM P54132 2/20 0.43
TSHR P16473 2/20 0.43
RECQL P46063 2/20 0.43
F2 P00734 1/20 0.43
F10 P00742 1/20 0.43
F12 P00748 1/20 0.43
F7 P08709 1/20 0.43
F3 P13726 1/20 0.43
PKM P14618 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
PARP1 P09874 1/20 0.43
MAPT P10636 1/20 0.43
PMP22 Q01453 1/20 0.43
HSD17B10 Q99714 1/20 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
Biphenyl SCHEMBL29103862 0.92 ALDH1A1 (0.45) CYP19A1CYP11B2TDP1CYP2C19L3MBTL1
SCHEMBL27744554 0.84 CYP19A1 (0.47) CYP19A1CYP11B2TDP1CYP2C19L3MBTL1
SCHEMBL27780001 0.81 GSK3A (0.42) CYP19A1CYP11B2TDP1CYP2C19L3MBTL1
SCHEMBL27684272 0.81 CYP19A1 (0.36) CYP19A1CYP11B2TDP1CYP2C19L3MBTL1
SCHEMBL27497496 0.78 ALDH1A1 (0.47) CYP19A1CYP11B2L3MBTL1PKMPOLB
SCHEMBL19864697 0.77 NFE2L2 (0.48) TDP1CYP2C19L3MBTL1BLMTSHR
SCHEMBL9184821 0.77 NFE2L2 (0.48) TDP1CYP2C19L3MBTL1BLMTSHR
SCHEMBL88322 0.75 ALDH1A1 (0.46) CYP19A1CYP11B2TDP1CYP2C19L3MBTL1
SCHEMBL3471389 0.74 BLM (0.48) TDP1CYP2C19L3MBTL1BLMTSHR
SCHEMBL2396375 0.74 BLM (0.48) TDP1CYP2C19L3MBTL1BLMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114959712-A Vapor phase corrosion inhibitor and preparation method thereof 中国石油化工股份有限公司 2022-08-30 CN claimed
CN-108314679-B Bactericide containing 1,3, 4-oxadiazole ring stilbene amide and preparation method and application thereof 华南理工大学 2021-06-08 CN claimed
CN-106663799-B Surface-coated cathode active material, method of preparing the same, and lithium secondary battery comprising the same 株式会社LG 化学 2019-11-08 CN claimed
CN-110408207-A A kind of polyimides polynary nanometer self-lubricating composite and preparation method thereof LANZHOU INST CHEMICAL PHYSICS CAS 2019-11-05 CN claimed
CN-110396233-A A kind of sponge urban ecology permeable pavement brick and preparation method thereof CHANGAN UNIV 2019-11-01 CN claimed
CN-109942527-A A kind of synthetic method of 3- bromine dibenzofurans 新乡市润宇新材料科技有限公司 2019-06-28 CN claimed
CN-109880133-A A kind of fluorine resin mixture film and copper-clad plate preparation method 久耀电子科技(江苏)有限公司 2019-06-14 CN claimed
CN-109876775-A A kind of metal organic framework fibrous material and preparation method thereof 中国石油化工股份有限公司 2019-06-14 CN claimed
CN-109735295-A A kind of acid imide organic silica gel and preparation method thereof 福建省海钛智能科技有限公司 2019-05-10 CN claimed
CN-109337056-A Graphene oxide modification of nylon/PI alloy and preparation method 吉林建筑大学 2019-02-15 CN claimed
CN-101142294-B Novel materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2011-12-07 CN claimed
CN-102076815-A Organic electroluminescent device MERCK PATENT GMBH 2011-05-25 CN claimed
CN-101679855-A The novel material that is used for organic electroluminescence device MERCK PATENT GMBH 2010-03-24 CN claimed
CN-101300214-A Organic electroluminescent device MERCK PATENT GMBH (DE) 2008-11-05 CN claimed
CN-101171320-A Organic electroluminescent device MERCK PATENT GMBH (DE) 2008-04-30 CN claimed
CN-101155896-A Organic electroluminescent device MERCK PATENT GMBH (DE) 2008-04-02 CN claimed
CN-101142294-A Novel materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2008-03-12 CN claimed
CN-1822811-A Hair colouring method, comprising reaction of a capped diazonium compound with the hair, and respective compositions and compounds CIBA SC HOLDING AG (CH) 2006-08-23 CN claimed
CN-1633275-A Method of colouring porous material CIBA SC HOLDING AG (CH) 2005-06-29 CN claimed
CN-1288925-A Soluble polyimide coating glue and its preparation and use CHINESE ACAD INST CHEMISTRY (CN) 2001-03-28 CN claimed