SCHEMBL6689910

SCHEMBL6689910

CCCCCC1CCCc2ccccc21

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.55
BCHE P06276 1/20 0.53
CYP19A1 P11511 1/20 0.50
TBXAS1 P24557 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
SCHEMBL30364914 1.00 SIGMAR1 (0.55) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28812914 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL29028262 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28543868 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28544038 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL30496006 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL7086030 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28544041 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL1760674 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28553249 0.98 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113912575-B Chiral polysubstituted tetrahydrofuran acetal and preparation method thereof, and preparation method of lignan natural product 上海交通大学 2023-09-22 CN disclosed
CN-114773303-B Preparation method of anticancer drug leader lignan Aglacin B 西南交通大学 2022-11-01 CN disclosed
CN-114773303-A Preparation method of anticancer drug leader lignan Aglacin B 西南交通大学 2022-07-22 CN disclosed
CN-114392301-A Preparation method and process of powder for promoting fracture healing 李廷懿 2022-04-26 CN disclosed
CN-113912575-A Chiral polysubstituted tetrahydrofuran acetal, preparation method thereof and preparation method of lignans natural product 上海交通大学 2022-01-11 CN disclosed
CN-110343045-B Aryltetrahydronaphthalene lignan compound and preparation and application thereof 中国科学院成都生物研究所 2021-11-12 CN disclosed
CN-110583658-B Application of Taiwanin H in preparation of herbicide 华南农业大学 2021-01-26 CN disclosed
CN-110583673-B Application of Taiwanin E in preparation of herbicide 华南农业大学 2020-10-23 CN disclosed
CN-110583673-A Application of Taiwanin E in preparation of herbicide 华南农业大学 2019-12-20 CN disclosed
CN-110583658-A Application of Taiwanin H in preparation of herbicide 华南农业大学 2019-12-20 CN disclosed
WO-2003017948-A2 ARYL TETRAHYDRONAPHTHALENE DERIVATIVES AVLAN LIMITED (GB) 2003-03-06 WO disclosed
WO-2003017948-A2 ARYL TETRAHYDRONAPHTHALENE DERIVATIVES AVLAN LIMITED (GB) 2003-03-06 WO disclosed
CN-1075316-A The Etoposide intermediates preparation BRISTOL MYERS SQUIBB CO (US) 1993-08-18 CN disclosed
CN-1021822-C Process for the preparation of intermediates useful in the preparation of epimedophyllotoxin BRISTOL MYERS CO (US) 1993-08-18 CN disclosed
CN-1074436-A The Etoposide intermediates preparation BRISTOL MYERS SQUIBB CO (US) 1993-07-21 CN disclosed
CN-1072171-A The Etoposide intermediates preparation BRISTOL MYERS SQUIBB CO (US) 1993-05-19 CN disclosed
CN-1020596-C PROCESS FOR PREPARING EPIPODOPHYLLOTOXIN INTERMEDIATES BRISTOL MYERS SQUIBB CO (US) 1993-05-12 CN disclosed
CN-1059513-A The Etoposide intermediates preparation BRISTOL MYERS SQUIBB CO (US) 1992-03-18 CN disclosed
CN-1059520-A The Etoposide intermediates preparation BRISTOL MYERS SQUIBB CO (US) 1992-03-18 CN disclosed
CN-86102404-A Intermediates for the preparation and use of epipodophyllotoxins 1986-12-03 CN disclosed