SCHEMBL26653397

SCHEMBL26653397

CC(C)C(C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.63
▸ NPC1L1 Q9UHC9 1/20 0.63
▸ USP2 O75604 1/20 0.63
▸ MAPT P10636 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ POLB P06746 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ CYP17A1 P05093 1/20 0.46
▸ CYP21A2 P08686 1/20 0.46
▸ PTPN1 P18031 1/20 0.46
▸ GPBAR1 Q8TDU6 3/20 0.45
▸ CYP3A4 P08684 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NR1I2 O75469 1/20 0.43
▸ PGR P06401 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ VDR P11473 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.41

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
SCHEMBL29486942 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL29486944 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL26653400 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL26653679 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL26653683 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL11232551 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL11232557 1.00 LMNA (0.63) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL15694774 0.89 POLB (0.62) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL29486954 0.89 NPC1L1 (0.49) LMNANPC1L1USP2MAPTALDH1A1
SCHEMBL26653373 0.89 NPC1L1 (0.49) LMNANPC1L1USP2MAPTALDH1A1

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-20230365616-A1 CHOLESTANE DERIVATIVES, PREPARATIONS CONTAINING THESE DERIVATIVES AND USE THEREOF UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2023-11-16 — — 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-20230365616-A1 CHOLESTANE DERIVATIVES, PREPARATIONS CONTAINING THESE DERIVATIVES AND USE THEREOF BAD, CYP27A1, NPC1L1 LMNA 1058/4885NPC1L1 3/4885USP2 2187/4885

“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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