Cholesterol

Cholesterol

SCHEMBL28412945

CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.Cl.O=C(O)/C=C\C(=O)O

nearest known ligand 0.84

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Cholesterol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OSBP P22059 4/20 0.84
RORC P51449 4/20 0.84
OSBP2 Q969R2 2/20 0.84
USP2 O75604 1/20 0.84
LMNA P02545 1/20 0.84
ABCB1 P08183 1/20 0.84
CYP46A1 Q9Y6A2 1/20 0.84
NR1H3 Q13133 7/20 0.73
EPHA2 P29317 1/20 0.73
GRIN1 Q05586 2/20 0.73
GRIN2A Q12879 2/20 0.73
NPC1L1 Q9UHC9 3/20 0.69
CRYAB P02511 1/20 0.69
HMGCR P04035 1/20 0.69
ITGB3 P05106 1/20 0.69
ITGAV P06756 1/20 0.69
SREBF2 Q12772 1/20 0.69
GRIN2B Q13224 1/20 0.68
POLA1 P09884 1/20 0.68
DHCR24 Q15392 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
Cholesterol SCHEMBL10379192 0.99 OSBP (0.86) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL19583430 0.99 OSBP (0.86) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL19583433 0.99 OSBP (0.86) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL10379694 0.95 OSBP (0.79) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL27833163 0.95 OSBP (0.82) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL27631455 0.94 OSBP (0.86) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL29502101 0.94 OSBP (0.93) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL27668883 0.94 OSBP (0.93) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL1369602 0.94 OSBP (0.93) OSBPRORCOSBP2USP2LMNA
Cholesterol SCHEMBL29046878 0.93 OSBP (0.79) OSBPRORCOSBP2USP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107652987-B Preparation method of maleic acid cholesterol monoester group citric acid triester liquid crystal 太原理工大学 2020-06-23 CN claimed
CN-107652987-B Preparation method of maleic acid cholesterol monoester group citric acid triester liquid crystal 太原理工大学 2020-06-23 CN disclosed