SCHEMBL26979040

SCHEMBL26979040

CCOC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@H]4[C@@H]3C[C@H]3OC32C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPC1L1 Q9UHC9 8/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ USP2 O75604 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ CDC25A P30304 5/20 0.50
▸ POLA1 P09884 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ CYP46A1 Q9Y6A2 1/20 0.43
▸ CDC25B P30305 1/20 0.43

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
SCHEMBL26121912 1.00 NPC1L1 (0.53) NPC1L1MEN1USP2LMNATP53
SCHEMBL26121915 1.00 NPC1L1 (0.53) NPC1L1MEN1USP2LMNATP53
SCHEMBL27125991 0.93 NPC1L1 (0.51) NPC1L1MEN1USP2LMNATP53
SCHEMBL26120983 0.93 NPC1L1 (0.51) NPC1L1MEN1USP2LMNATP53
SCHEMBL26120987 0.93 NPC1L1 (0.51) NPC1L1MEN1USP2LMNATP53
SCHEMBL26980634 0.93 NPC1L1 (0.51) NPC1L1MEN1USP2LMNATP53
SCHEMBL6303110 0.90 NPC1L1 (0.55) NPC1L1MEN1USP2LMNATP53
SCHEMBL9133868 0.90 NPC1L1 (0.55) NPC1L1MEN1USP2LMNATP53
SCHEMBL6300889 0.90 NPC1L1 (0.55) NPC1L1MEN1USP2LMNATP53
SCHEMBL6300887 0.90 NPC1L1 (0.55) NPC1L1MEN1USP2LMNATP53

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-20240002429-A1 PRODRUG OF 5a-HYDROXY-6ß-[2-(1H-IMIDAZOL-4-YL)ETHYLAMINO]CHOLESTAN-3ß-OL AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME FOR USE IN THE TREATMENT OF CANCER DENDROGENIX (BE) 2024-01-04 — — 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-20240002429-A1 PRODRUG OF 5a-HYDROXY-6ß-[2-(1H-IMIDAZOL-4-YL)ETHYLAMINO]CHOLESTAN-3ß-OL AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME FOR USE IN THE TREATMENT OF CANCER CYP7A1, CYP46A1, ABCB11 NPC1L1 71/4885MEN1 1148/4885USP2 3588/4885

“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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