SCHEMBL509817

SCHEMBL509817

CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3(F)[C@@H](OC(=O)CC)C[C@@]21C

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 7/20 0.84
▸ PGR P06401 5/20 0.84
▸ ADORA3 P0DMS8 2/20 0.84
▸ NR1I2 O75469 2/20 0.84
▸ MAPT P10636 2/20 0.84
▸ DRD2 P14416 1/20 0.84
▸ OPRD1 P41143 1/20 0.84
▸ USP2 O75604 7/20 0.72
▸ CYP3A4 P08684 6/20 0.72
▸ HIF1A Q16665 2/20 0.72
▸ AR P10275 1/20 0.72
▸ CHRM1 P11229 1/20 0.72
▸ CNR1 P21554 1/20 0.72
▸ TBXA2R P21731 1/20 0.72
▸ LMNA P02545 3/20 0.70
▸ CYP2C9 P11712 2/20 0.70
▸ MLNR O43193 1/20 0.70
▸ ABCB11 O95342 1/20 0.70
▸ CYP3A5 P20815 1/20 0.70
▸ PPARG P37231 1/20 0.70

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
SCHEMBL29395436 1.00 NR3C1 (0.84) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL11748332 1.00 NR3C1 (0.84) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL4174889 0.96 NR3C1 (0.77) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL1530974 0.95 NR3C1 (0.80) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL7593 0.95 NR3C1 (0.82) NR3C1PGRADORA3NR1I2MAPT
Butyric Acid SCHEMBL4899027 0.95 NR3C1 (0.76) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL7271 0.95 NR3C1 (0.78) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL20485505 0.95 NR3C1 (0.78) NR3C1PGRADORA3NR1I2MAPT
SCHEMBL11749891 0.95 NR3C1 (0.76) NR3C1PGRADORA3NR1I2MAPT
Betamethasone Dipropionate SCHEMBL15876389 0.94 NR3C1 (0.88) NR3C1PGRADORA3NR1I2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024125322-A1 DIPYRIDAMOLE FOR PREVENTING AND TREATING ALLERGIC AND/OR INFLAMMATORY DISEASES AND PREPARATION THEREOF 智泽童康(广州)生物科技有限公司 2024-06-20 — — WO claimed
CN-117849228-A Biomarker for screening early sexual precocity and application thereof 裕菁科技(上海)有限公司 2024-04-09 — — CN claimed
CN-116999412-A Sustained-release microsphere preparation containing betamethasone medicine and preparation method thereof 四川迈可隆生物科技有限公司 2023-11-07 — — CN claimed
CN-116265017-A Pharmaceutical composition comprising benvimod and corticosteroid 上海泽德曼医药科技有限公司 2023-06-20 — — CN claimed
CN-113057943-B Betamethasone dipropionate nano freeze-dried powder injection and preparation method thereof 东南大学 2022-04-26 — — CN claimed
CN-110082462-B Chromatography-mass spectrometry detection method for glucocorticoid and sex hormone in cosmetics 宁波检验检疫科学技术研究院 2021-11-19 — — CN claimed
CN-113057943-A Betamethasone dipropionate nano freeze-dried powder injection and preparation method thereof 东南大学 2021-07-02 — — CN claimed
CN-110693819-B Pharmaceutical composition for preventing and treating acarid dermatitis and preparation method thereof 吉林大学 2020-10-27 — — CN claimed
CN-107664671-B Method for detecting residual medicine of animal-derived food 广东省药品检验所(广东省药品质量研究所、广东省口岸药品检验所) 2020-08-28 — — CN claimed
CN-111132982-A Compositions and methods for modulating short-chain dehydrogenase activity 卡斯西部储备大学 2020-05-08 — — CN claimed
WO-2009117120-A1 PURIFICATION OF AIR SENSITIVE STEROIDS SICOR INC. (US) 2009-09-24 — — WO claimed
WO-2009024964-A2 COMPOSITION AND METHOD FOR THE TREATMENT OF OTITIS EXTERNA PRIMOR NITSAN (IL) 2009-02-26 — — WO claimed
EP-1863493-A1 CORTICOSTEROID CONTAINING FORMULATION FOR TREATING PSORIASIS, ECZEMA, ULCER AND BURNS. El Masri, Mohamed Zakaria Ahmed (EG) 2007-12-12 — — EP claimed
WO-2006092151-A1 TOPICAL CORTICOSTEROID CONTAINING FORMULATION FOR TREATMENT OF PSORIASIS, ECZEMA, ULCER AND BURNS EL MASRI MOHAMED ZAKARIA AHMED (EG) 2006-09-08 — — WO claimed
US-6890544-B2 Gel composition for the topical treatment of poison ivy and other forms of contact dermatitis MCCADDEN MICHAEL E (US) 2005-05-10 — — US claimed
US-20030232086-A1 Gel composition for the topical treatment of rashes, dermatoses and lesions MCCADDEN MICHAEL E (US) 2003-12-18 — — US claimed
US-6656928-B1 Composition for the topical treatment of rashes, dermatoses and lesions MCCADDEN MICHAEL E (US) 2003-12-02 — — US claimed
US-20030077304-A1 Gel composition for the topical treatment of poison ivy and other forms of contact dermatitis MCCADDEN MICHAEL E (US) 2003-04-24 — — US claimed
US-6479058-B1 Composition for the topical treatment of poison ivy and other forms of contact dermatitis MCCADDEN MICHAEL E (US) 2002-11-12 — — US claimed
US-4244942-A Creamy preparation containing steroid and process for the preparation thereof TOKO YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 1981-01-13 — — US claimed
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