SCHEMBL31504615

SCHEMBL31504615

CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)(C)O)[C@@]4(C)CC[C@@H]32)C1=O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1L1 Q9UHC9 7/20 0.61
▸ NR1H3 Q13133 2/20 0.61
▸ CRYAB P02511 1/20 0.61
▸ HMGCR P04035 1/20 0.61
▸ ITGB3 P05106 1/20 0.61
▸ ITGAV P06756 1/20 0.61
▸ OSBP P22059 1/20 0.61
▸ RORC P51449 1/20 0.61
▸ SREBF2 Q12772 1/20 0.61
▸ OSBP2 Q969R2 1/20 0.61
▸ GRIN1 Q05586 7/20 0.55
▸ GRIN2B Q13224 7/20 0.55
▸ GRIN2A Q12879 6/20 0.55
▸ SRD5A1 P18405 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
SCHEMBL31504640 0.89 PTPN1 (0.59) NPC1L1NR1H3SRD5A1
SCHEMBL25333524 0.87 NPC1L1 (0.70) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL25333525 0.87 NPC1L1 (0.70) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL7753172 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL10784914 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL8561190 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL8561197 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL23312299 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL11650951 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3
SCHEMBL8636407 0.83 NR1H3 (0.78) NPC1L1NR1H3CRYABHMGCRITGB3

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
US-20250154193-A1 STEROID COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Cholesgen (Shanghai) Co., Ltd. (CN) 2025-05-15 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250154193-A1 STEROID COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SREBF1, SREBF2, CYP46A1 NPC1L1 62/4885NR1H3 5/4885CRYAB 3795/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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