SCHEMBL7989828

SCHEMBL7989828

CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4CC(OC=O)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP46A1 Q9Y6A2 2/20 0.75
POLA1 P09884 1/20 0.74
OSBP P22059 4/20 0.70
RORC P51449 3/20 0.70
USP2 O75604 2/20 0.70
OSBP2 Q969R2 2/20 0.70
LMNA P02545 1/20 0.70
ABCB1 P08183 1/20 0.70
NR1H3 Q13133 3/20 0.62
GRIN1 Q05586 1/20 0.60
GRIN2A Q12879 1/20 0.60
GBA1 P04062 2/20 0.59
UGCG Q16739 2/20 0.59
GBA2 Q9HCG7 2/20 0.59
NPC1L1 Q9UHC9 4/20 0.59
SRD5A1 P18405 2/20 0.58
CRYAB P02511 1/20 0.57
HMGCR P04035 1/20 0.57
ITGB3 P05106 1/20 0.57
ITGAV P06756 1/20 0.57

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
SCHEMBL13523734 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL15605473 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL1369754 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL18627850 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL1045464 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL13758209 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL19460299 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL22523945 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL21935259 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2
SCHEMBL13072641 1.00 CYP46A1 (0.75) CYP46A1POLA1OSBPRORCUSP2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2206684-A None JP disclosed
JP-2164898-A None JP disclosed
CN-1103695-C Heat sensitive recording carrier as sustit. Therefor TOSHIBA KK (JP) 2003-03-26 CN 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
US-5869420-A Rewritable thermal recording medium KABUSHIKI KAISHA TOSHIBA (JP) 1999-02-09 US disclosed
CN-1141243-A Heat sensitive recording carrier as sustit. Therefor TOSHIBA KK (JP) 1997-01-29 CN 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
JP-H02206684-A LIQUID CRYSTAL COMPOSITION N O K SOGO GIJUTSU KENKYUSHO:KK 1990-08-16 JP disclosed
JP-H02164898-A NEW LIQUID CRYSTAL SUBSTANCE N O K SOGO GIJUTSU KENKYUSHO:KK 1990-06-25 JP disclosed
US-4060910-A Orientation system GELL JR HAROLD A 1977-12-06 US disclosed