SCHEMBL31504641

SCHEMBL31504641

COC(=O)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 2/20 0.76
▸ USP2 O75604 1/20 0.76
▸ CYP2C9 P11712 1/20 0.67
▸ HIF1A Q16665 1/20 0.67
▸ GPBAR1 Q8TDU6 1/20 0.67
▸ CDC25A P30304 3/20 0.61
▸ POLA1 P09884 1/20 0.61
▸ ST6GAL1 P15907 1/20 0.60

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
SCHEMBL31504637 1.00 VDR (0.76) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL18575980 0.97 VDR (0.75) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL19549010 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL22871979 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL20980004 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL19565572 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL7996253 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL3694684 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL17777260 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1
SCHEMBL19549008 0.94 VDR (0.82) VDRUSP2CYP2C9HIF1AGPBAR1

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 VDR 408/4885USP2 3504/4885CYP2C9 961/4885

“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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