SCHEMBL138289

SCHEMBL138289

COC1CC(=O)C=C2CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]3[C@]21C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.67
CYP3A4 P08684 6/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
LMNA P02545 4/20 0.67
MAPT P10636 4/20 0.67
SERPINA6 P08185 4/20 0.67
MAPK1 P28482 3/20 0.67
CYP2C9 P11712 2/20 0.67
TSHR P16473 2/20 0.67
HIF1A Q16665 2/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
ABCB11 O95342 2/20 0.67
SHBG P04278 2/20 0.67
NR3C2 P08235 2/20 0.67
GPBAR1 Q8TDU6 2/20 0.67
CYP2C19 P33261 1/20 0.67
KDM4E B2RXH2 1/20 0.67
SLC22A2 O15244 1/20 0.67
SLC22A1 O15245 1/20 0.67

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
Acetic Acid SCHEMBL582377 0.98 ALDH1A1 (0.64) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL220822 0.91 ALDH1A1 (0.62) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL9360183 0.91 CYP3A4 (0.62) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL10893814 0.91 ALDH1A1 (0.62) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL6684640 0.90 CYP3A4 (0.61) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL28255051 0.88 CYP3A4 (0.59) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
Water SCHEMBL15951778 0.88 ALDH1A1 (0.59) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL4749451 0.88 ALDH1A1 (0.59) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL28718285 0.88 CYP3A4 (0.59) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT
SCHEMBL2042111 0.87 CYP3A4 (0.58) ALDH1A1CYP3A4SMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109966502-B Composition for improving solubility of poorly soluble substance, use thereof, and complex preparation containing same 财团法人工业技术研究院 2023-01-24 CN claimed
US-20190209706-A1 COMPOSITION FOR IMPROVING THE SOLUBILITY OF POORLY SOLUBLE SUBSTANCES, USE THEREOF AND COMPLEX FORMULATION CONTAINING THEREOF INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-07-11 US claimed
CN-109966502-A For improve the composition of the solubility of indissoluble object, its purposes with containing its compound formulation 财团法人工业技术研究院 2019-07-05 CN claimed
EP-1922094-B1 DEVICES FOR LYMPHATIC TARGETING LIU JIANG (CN) 2015-09-30 EP claimed
EP-2773333-A1 DERMAL DELIVERY COMPOSITIONS AND METHODS Agile Therapeutics, Inc. (US) 2014-09-10 EP claimed
WO-2013067346-A1 DERMAL DELIVERY COMPOSITIONS AND METHODS AGILE THERAPEUTICS, INC. (US) 2013-05-10 WO claimed
EP-0579435-B1 Cyclodextrin complexation CYCLOPS H F (IS) 1999-03-17 EP claimed
US-4215691-A Vaginal contraceptive system made from block copolymer ALZA CORPORATION (US) 1980-08-05 US claimed
JP-9315977-A None JP disclosed
US-20240016954-A1 COMPOSITION FOR IMPROVING THE SOLUBILITY OF POORLY SOLUBLE SUBSTANCES, COMPLEX FORMULATION AND LIQUID FORMULATION OF AN ACTIVE INGREDIENT INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2024-01-18 US disclosed
US-11801310-B2 Composition for improving the solubility of poorly soluble substances, use thereof and complex formulation containing thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2023-10-31 US disclosed
CN-115850248-A Teninil antitumor drug compound and preparation method and application thereof 南京友怡医药科技有限公司 2023-03-28 CN disclosed
CN-115768464-A Methods of generating engineered memory-like NK cells and compositions thereof 麻省理工学院 2023-03-07 CN disclosed
CN-109966502-B Composition for improving solubility of poorly soluble substance, use thereof, and complex preparation containing same 财团法人工业技术研究院 2023-01-24 CN disclosed
WO-1993002065-A1 NEW DERIVATIVES OF TAXOL ANALOGUES, PREPARATION THEREOF AND COMPOSITIONS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1993-02-04 WO disclosed
EP-0524093-A1 Derivatives of analogues of taxol, their preparation and compositons containing them Aventis Pharma S.A. (FR) 1993-01-20 EP disclosed
EP-0514373-A1 Use of melatonin for treating pre-menstrual syndrome. AMR INT (US) 1992-11-25 EP disclosed
WO-1992009589-A1 METHOD FOR PREPARING TAXANE DERIVATIVES, NOVEL DERIVATIVES THEREBY OBTAINED AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1992-06-11 WO disclosed
WO-1991012007-A1 METHOD OF TREATING PRE-MENSTRUAL SYNDROME APPLIED MED RES (US) 1991-08-22 WO disclosed
US-4945103-A Method of treating pre-menstrual syndrome APPLIED MEDICAL RESEARCH 1990-07-31 US disclosed