SCHEMBL28095059

SCHEMBL28095059

CC1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.76
CYP3A4 P08684 1/20 0.65
LMNA P02545 2/20 0.62
MAPT P10636 2/20 0.62
SHBG P04278 1/20 0.50

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
SCHEMBL14046282 1.00 CYP19A1 (0.76) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL11020843 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL13001778 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL4361013 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL12430769 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL15903 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL13787743 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL13994334 0.86 CYP19A1 (0.74) CYP19A1CYP3A4LMNAMAPT
SCHEMBL4431797 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG
SCHEMBL13752636 0.86 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPTSHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428796-A S (alkynyl of 4 (the methylbutyryl epoxide of 3 fluorine 3) fourth 2) 6 α, the crystal form of the β carbothioic acid esters of 1,4 diene of the α of 9 α difluoros 17 (base of furans 2) carbonyloxy group 11 β hydroxyls, 16 α methyl, 3 oxoandrost 17 太阳医药高级研究有限公司 2017-12-01 CN claimed
CN-106520693-B Memory B cell precursor and application thereof 清华大学 2019-11-22 CN disclosed
CN-110003192-A Substituted amino-metadiazine compound and its application method and purposes 广东东阳光药业有限公司 2019-07-12 CN disclosed
CN-106478651-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2019-07-09 CN disclosed
CN-105367555-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2019-06-25 CN disclosed
CN-105130966-B Alkynyl compounds and its application method and purposes 广东东阳光药业有限公司 2019-05-24 CN disclosed
CN-106478607-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2019-05-24 CN disclosed
CN-105461694-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2019-05-24 CN disclosed
CN-109776522-A Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2019-05-21 CN disclosed
CN-109438543-A A kind of preparation method of high-purity fluticasone furoate 广州健康元呼吸药物工程技术有限公司 2019-03-08 CN disclosed
CN-104926794-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2017-12-05 CN disclosed
CN-107428796-A S (alkynyl of 4 (the methylbutyryl epoxide of 3 fluorine 3) fourth 2) 6 α, the crystal form of the β carbothioic acid esters of 1,4 diene of the α of 9 α difluoros 17 (base of furans 2) carbonyloxy group 11 β hydroxyls, 16 α methyl, 3 oxoandrost 17 太阳医药高级研究有限公司 2017-12-01 CN disclosed
CN-104926795-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2017-11-10 CN disclosed
CN-104650092-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2017-11-10 CN disclosed
CN-104672250-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2017-11-07 CN disclosed
CN-104974163-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2017-11-07 CN disclosed
CN-107106516-A Pharmaceutical combination product 葛兰素史克知识产权开发有限公司 2017-08-29 CN disclosed
CN-107072976-A Pharmaceutical composition comprising Danirixin for the treatment of infectious diseases 葛兰素史克知识产权第二有限公司 2017-08-18 CN disclosed
CN-104926824-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2017-07-07 CN disclosed
CN-106029140-A Inhaler 鲁平有限公司 2016-10-12 CN disclosed