SCHEMBL25337262

SCHEMBL25337262

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

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OSBP P22059 3/20 0.66
▸ OSBP2 Q969R2 3/20 0.66
▸ NPC1L1 Q9UHC9 5/20 0.60
▸ CRYAB P02511 1/20 0.55
▸ HMGCR P04035 1/20 0.55
▸ ITGB3 P05106 1/20 0.55
▸ ITGAV P06756 1/20 0.55
▸ RORC P51449 1/20 0.55
▸ SREBF2 Q12772 1/20 0.55
▸ NR1H3 Q13133 1/20 0.55
▸ GPR183 P32249 5/20 0.50
▸ VDR P11473 3/20 0.50
▸ GRIN1 Q05586 4/20 0.49
▸ GRIN2B Q13224 4/20 0.49
▸ GRIN2A Q12879 3/20 0.49

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
SCHEMBL25337887 0.89 OSBP (0.63) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL30526194 0.88 OSBP (0.65) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL27506889 0.85 OSBP (0.66) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL16226376 0.84 PTPN1 (0.48) OSBPOSBP2NPC1L1VDR
SCHEMBL25335224 0.83 OSBP (0.56) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL25335220 0.83 OSBP (0.56) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL25337771 0.81 OSBP (0.70) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL25339858 0.81 OSBP (0.70) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL11571094 0.81 OSBP (0.75) OSBPOSBP2NPC1L1CRYABHMGCR
SCHEMBL11524136 0.81 OSBP (0.75) OSBPOSBP2NPC1L1CRYABHMGCR

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
WO-2023143399-A1 STEROID COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 珂阑(上海)医药科技有限公司 2023-08-03 — — WO disclosed
CN-116514893-A Steroid compound, preparation method and application thereof 珂阑(上海)医药科技有限公司 2023-08-01 — — CN disclosed
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