SCHEMBL4739364

SCHEMBL4739364

CC(=O)OC1CC[C@@]2(C)C(CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.79
USP2 O75604 1/20 0.79
CDC25A P30304 4/20 0.77
POLA1 P09884 1/20 0.76
CYP2D6 P10635 1/20 0.66
CYP2C19 P33261 1/20 0.66
INPP5D Q92835 1/20 0.65
ST6GAL1 P15907 1/20 0.61
FOLH1 Q04609 1/20 0.60
ABCC4 O15439 1/20 0.59

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
SCHEMBL19232373 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL15372968 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL11371121 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL4739362 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL106015 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL24403430 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL10052613 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL13214256 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL12205280 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL15289783 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030157158-A1 Enhanced liposomal thioretinaco ozonide compositions and liposomal carrier MCCULLY KILMER S (US) 2003-08-21 US claimed
WO-2003057192-A1 ENHANCED LIPOSOMAL THIORETINACO OZONIDE COMPOSITIONS AND LIPOSOMAL CARRIER MCCULLY KILMER S (US) 2003-07-17 WO claimed
JP-2200608-A None JP disclosed
WO-2008131192-A2 CRYSTALLINE CHOLESTROL AND PREVENTION OF ATHEROSCLEROSIS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2008-10-30 WO disclosed
WO-2008077247-A1 COATINGS FOR IMPLANTABLE MEDICAL DEVICES COMPRISING CHOLESTEROL MIV THERAPEUTICS INC. (CA) 2008-07-03 WO disclosed
US-6696082-B2 COMPLEX COMPRISING N-HOMOCYSTEINE THIOLACTONYL RETINAMIDE, COBALAMIN, OZONE, OXYGEN, AND ADENOSINE TRIPHOSPHATE; ANTICARCINGENIC, ANTITUMOR, AND VIRICIDAL AGENTS; ATHEROSCLEROSIS PREVENTION; AGING RESISTANCE MCCULLY KILMER S (US) 2004-02-24 US disclosed
US-20030157158-A1 Enhanced liposomal thioretinaco ozonide compositions and liposomal carrier MCCULLY KILMER S (US) 2003-08-21 US disclosed
WO-2003057192-A1 ENHANCED LIPOSOMAL THIORETINACO OZONIDE COMPOSITIONS AND LIPOSOMAL CARRIER MCCULLY KILMER S (US) 2003-07-17 WO disclosed
US-6274118-B1 INJECTING PATIENT HAVING ENDOCRINE CANCER IN NON-PROSTATIC TISSUE WITH BIOLOGICAL BINDING UNITS WHICH BIND TO PROSTATE SPECIFIC ANTIGEN PRODUCED BY NON-PROSTATIC TISSUE NORDION INTERNATIONAL INC. (CA) 2001-08-14 US disclosed
EP-0786999-A4 COMBINATION METHOD FOR ACNE TREATMENT MERCK & CO INC (US) 1999-01-20 EP disclosed
EP-0792371-A4 COMBINATION METHOD FOR ACNE TREATMENT MERCK & CO INC (US) 1998-12-30 EP disclosed
WO-1996012817-A1 COMBINATION METHOD FOR ACNE TREATMENT MERCK & CO., INC. (US) 1996-05-02 WO disclosed
WO-1996012487-A1 COMBINATION METHOD FOR ACNE TREATMENT MERCK & CO., INC. (US) 1996-05-02 WO disclosed
WO-1995013815-A1 COMBINATION METHOD FOR THE TREATMENT OF PATTERNED ALOPECIA MERCK & CO., INC. (US) 1995-05-26 WO disclosed
WO-1995013077-A1 7β-SUBSTITUTED-4-AZA-5α-CHOLESTAN-3-ONES AS SELECTIVE 5α-REDUCTASE 1 INHIBITORS MERCK & CO., INC. (US) 1995-05-18 WO disclosed
WO-1995002424-A1 LOCALIZATION AND THERAPY OF NON-PROSTATIC ENDOCRINE CANCER WITH AGENTS DIRECTED AGAINST PROSTATE SPECIFIC ANTIGEN NORDION INTERNATIONAL INC. (CA) 1995-01-26 WO disclosed
EP-0572165-A1 New 7B-substituted-4-aza-5a-cholestan-ones as 5a-reductase inhibitors MERCK & CO. INC. (US) 1993-12-01 EP disclosed
WO-1993023419-A1 NEW 7β-SUBSTITUTED-4-AZA-5α-CHOLESTAN-ONES AS 5α-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 WO disclosed
WO-1993023039-A1 SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 WO disclosed
JP-H02200608-A COSMETIC POLA CHEM IND INC 1990-08-08 JP disclosed