SCHEMBL25335224

SCHEMBL25335224

CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](C(C)CCCC(C)(C)O)CC[C@H]4[C@@H]3CC[C@H]2C1(C)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OSBP P22059 2/20 0.56
▸ OSBP2 Q969R2 2/20 0.56
▸ NPC1L1 Q9UHC9 6/20 0.51
▸ VDR P11473 4/20 0.49
▸ USP2 O75604 1/20 0.49
▸ NR1H3 Q13133 2/20 0.47
▸ CRYAB P02511 1/20 0.47
▸ HMGCR P04035 1/20 0.47
▸ ITGB3 P05106 1/20 0.47
▸ ITGAV P06756 1/20 0.47
▸ RORC P51449 1/20 0.47
▸ SREBF2 Q12772 1/20 0.47
▸ CDC25A P30304 1/20 0.45
▸ GRIN1 Q05586 1/20 0.44
▸ GRIN2A Q12879 1/20 0.44
▸ GRIN2B Q13224 1/20 0.44
▸ AKR1B10 O60218 1/20 0.44
▸ AKR1B1 P15121 1/20 0.44
▸ EFNA1 P20827 1/20 0.44
▸ EPHA2 P29317 1/20 0.44

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
SCHEMBL25335220 1.00 OSBP (0.56) OSBPOSBP2NPC1L1VDRUSP2
SCHEMBL25337262 0.83 OSBP (0.66) OSBPOSBP2NPC1L1VDRNR1H3
SCHEMBL30606530 0.81 OSBP (0.45) OSBPOSBP2NPC1L1VDRUSP2
SCHEMBL11785339 0.80 VDR (0.75) OSBPOSBP2VDRUSP2CDC25A
SCHEMBL6387158 0.80 VDR (0.75) OSBPOSBP2VDRUSP2CDC25A
SCHEMBL27506889 0.79 OSBP (0.66) OSBPOSBP2NPC1L1VDRNR1H3
SCHEMBL31504633 0.79 OSBP (0.55) OSBPOSBP2NPC1L1VDRUSP2
SCHEMBL11788002 0.78 NPC1L1 (0.56) OSBPOSBP2NPC1L1VDRUSP2
SCHEMBL6393234 0.78 NPC1L1 (0.56) OSBPOSBP2NPC1L1VDRUSP2
SCHEMBL5070148 0.77 CDC25A (0.54) OSBPOSBP2NPC1L1VDRNR1H3

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 1 patent. 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
Send feedback