SCHEMBL11399007

SCHEMBL11399007

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OSBP P22059 3/20 0.75
▸ OSBP2 Q969R2 3/20 0.75
▸ GPBAR1 Q8TDU6 6/20 0.68
▸ MAPT P10636 1/20 0.68
▸ THRB P10828 1/20 0.68
▸ NPC1L1 Q9UHC9 4/20 0.67
▸ CRYAB P02511 1/20 0.62
▸ HMGCR P04035 1/20 0.62
▸ ITGB3 P05106 1/20 0.62
▸ ITGAV P06756 1/20 0.62
▸ RORC P51449 1/20 0.62
▸ SREBF2 Q12772 1/20 0.62
▸ NR1H3 Q13133 1/20 0.62
▸ GPR183 P32249 3/20 0.56
▸ USP2 O75604 1/20 0.55
▸ LMNA P02545 1/20 0.55

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
SCHEMBL11399025 1.00 OSBP (0.75) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL25338196 1.00 OSBP (0.75) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL25339557 1.00 OSBP (0.75) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL12526779 0.94 GPBAR1 (0.69) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL5341062 0.87 GPBAR1 (0.72) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL21000302 0.87 GPBAR1 (0.72) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL20972927 0.87 GPBAR1 (0.72) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL20972926 0.87 GPBAR1 (0.72) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL14490144 0.87 GPBAR1 (0.72) OSBPOSBP2GPBAR1MAPTTHRB
SCHEMBL22472242 0.87 GPBAR1 (0.72) OSBPOSBP2GPBAR1MAPTTHRB

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
JP-55066600-A — — None — — JP disclosed
JP-S5566600-A PREPARATION OF 3BETA,25-DEHYDROXY-5ALPHA-CHOLEST-5-ENE OR ITS 3BETA- ACETATE TEIJIN LTD 1980-05-20 — — JP disclosed
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