SCHEMBL1901373

SCHEMBL1901373

CC[C@H]1CC[C@H]2[C@@H]3C=CC4=CCCC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ PGR P06401 1/20 0.42
▸ AR P10275 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ TBXA2R P21731 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ CYP19A1 P11511 17/20 0.40
▸ SRD5A2 P31213 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
SCHEMBL5487403 0.83 PGR (0.44) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL3385849 0.83 PGR (0.44) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL10815083 0.81 CYP19A1 (0.33) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL3356237 0.80 SRD5A2 (0.41) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL10897035 0.79 PGR (0.67) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL30646413 0.78 DHCR24 (0.47) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL30646412 0.78 DHCR24 (0.47) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL29365095 0.78 CYP19A1 (0.40) CYP19A1
SCHEMBL11211124 0.78 SRD5A2 (0.48) ALDH1A1CYP3A4CYP2C19PGRAR
SCHEMBL9012608 0.78 SRD5A2 (0.40) ALDH1A1CYP3A4CYP2C19PGRAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591656-A Filtering liquid, preparation method thereof and application of filtering liquid in photocatalytic preparation of dydrogesterone key intermediate 仁合益康集团有限公司 2025-03-11 — — CN claimed
EP-0157842-B1 NEW PROCESS FOR THE PREPARATION OF 17$g(a)-HYDROXY 19-NOR-PROGESTERONE DERIVATIVES THERAMEX S.A. (MC) 1989-07-19 — — EP claimed
CN-119591656-A Filtering liquid, preparation method thereof and application of filtering liquid in photocatalytic preparation of dydrogesterone key intermediate 仁合益康集团有限公司 2025-03-11 — — CN disclosed
CN-115215917-B Thioether compound, preparation method and application thereof 扬州奥锐特药业有限公司 2024-01-26 — — CN disclosed
CN-114249790-B Preparation method of steroid compound 扬州奥锐特药业有限公司 2022-10-18 — — CN disclosed
CN-114249790-A Preparation method of steroid compound 扬州奥锐特药业有限公司 2022-03-29 — — CN disclosed
US-20140200201-A1 Enzymatic Production or Chemical Synthesis and Uses for 5,7-Dienes and UVB Conversion Products Thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2014-07-17 — — US disclosed
US-20120258938-A1 Enzymatic Production or Chemical Synthesis and Uses for 5,7-Dienes and UVB Conversion Products Thereof SLOMINSKI ANDREJ (US) 2012-10-11 — — US disclosed
US-20110118228-A1 Enzymatic production or chemical synthesis and uses for 5,7-dienes and UVB conversion products thereof SLOMINSKI ANDRZEJ 2011-05-19 — — US disclosed
WO-2009108388-A2 ENZYMATIC PRODUCTION OR CHEMICAL SYNTHESIS AND USES FOR 5,7-DIENES AND UVB CONVERSION PRODUCTS THEREOF UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2009-09-03 — — WO disclosed
WO-1990010638-A1 ANTITUMORAL AGENTS WITH AN AFFINITY FOR STEROID HORMONE RECEPTORS EISENBRAND GERHARD (DE) 1990-09-20 — — WO disclosed
US-4267173-A SAID HALOGENOCORTICOIDS BEING A 6B-FLUORO-7A-HALOGENO-1,4-PREGNADIENE SCHERING CORPORATION (US) 1981-05-12 — — US disclosed
US-4201778-A 6-Acyloxy-1,4,6-pregnatrienes, their use as anti-inflammatory agents, methods for their manufacture, and 6-oxo-1,4-pregnadiene intermediates SCHERING CORPORATION (US) 1980-05-06 — — US disclosed
US-4181669-A A CARBODIIMIDE WITH ACID CATALYSTS AS A CONDENSATION AGENT AKTIEBOLAGET LEO (SE) 1980-01-01 — — US disclosed
US-4180504-A Method for the preparation of esters AKTIEBOLAGET LEO (SE) 1979-12-25 — — US disclosed
US-4177269-A ANTITUMOR AGENTS AKTIEBOLAGET LEO (SE) 1979-12-04 — — US disclosed
EP-0001864-A1 Novel 6-oxygenated-3,20-dioxo-pregnane derivatives, process for the preparation thereof, and pharmaceutical compositions containing them Technobiotic Ltd. (CH) 1979-05-16 — — EP disclosed
US-4076708-A Process for the preparation of 7α-halogeno-3-oxo-4-dehydro steroids and novel 7α-halogeno derivatives produced thereby SCHERING CORPORATION (US) 1978-02-28 — — US disclosed
US-3956349-A TRIETHYL ORTHOACETATE, ACID CATALYST SYNTEX (U.S.A.) INC. (US) 1976-05-11 — — US disclosed
US-3931167-A Process for the manufacture of 3-keto-6-azido-4,6-bis-dehydro-steroids and intermediates useful therein SCHERING CORPORATION (US) 1976-01-06 — — US disclosed
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