SCHEMBL24358440

SCHEMBL24358440

C/C=C\[C@@H](C)[C@H]1CCC2C3CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1L1 Q9UHC9 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPT P10636 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ PTPN1 P18031 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ POLA1 P09884 1/20 0.38
▸ GPBAR1 Q8TDU6 2/20 0.38
▸ THRB P10828 1/20 0.38
▸ BACE1 P56817 1/20 0.38

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
SCHEMBL26653694 1.00 NPC1L1 (0.51) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26783736 1.00 NPC1L1 (0.51) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26783733 1.00 NPC1L1 (0.51) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26653373 0.90 NPC1L1 (0.49) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26653376 0.90 NPC1L1 (0.49) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL29486954 0.90 NPC1L1 (0.49) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26783767 0.89 NPC1L1 (0.51) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26785093 0.89 NPC1L1 (0.51) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL24358400 0.88 NPC1L1 (0.52) NPC1L1USP2LMNAMAPTALDH1A1
SCHEMBL26783716 0.88 NPC1L1 (0.52) NPC1L1USP2LMNAMAPTALDH1A1

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
US-20230365616-A1 CHOLESTANE DERIVATIVES, PREPARATIONS CONTAINING THESE DERIVATIVES AND USE THEREOF UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2023-11-16 — — US disclosed
WO-2022083809-A1 CHOLESTANE DERIVATIVES, PREPARATIONS CONTAINING THESE DERIVATIVES AND USE THEREOF Univerzita Palackého v Olomouci (CZ) 2022-04-28 — — WO 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-20230365616-A1 CHOLESTANE DERIVATIVES, PREPARATIONS CONTAINING THESE DERIVATIVES AND USE THEREOF BAD, CYP27A1, NPC1L1 NPC1L1 3/4885USP2 2187/4885LMNA 1058/4885

“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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