SCHEMBL26653619

SCHEMBL26653619

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ USP2 O75604 2/20 0.47
▸ NPC1L1 Q9UHC9 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ NR1I2 O75469 1/20 0.46
▸ PGR P06401 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP3A4 P08684 2/20 0.44
▸ PTPN1 P18031 1/20 0.43
▸ AR P10275 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ ABCB11 O95342 1/20 0.42
▸ ESR1 P03372 1/20 0.42
▸ HSPD1 P10809 1/20 0.42

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
SCHEMBL26653624 1.00 ALDH1A1 (0.47) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL26653373 0.88 NPC1L1 (0.49) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL26653376 0.88 NPC1L1 (0.49) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL29486954 0.88 NPC1L1 (0.49) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL29486944 0.87 LMNA (0.63) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL11232551 0.87 LMNA (0.63) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL11232557 0.87 LMNA (0.63) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL26653679 0.87 LMNA (0.63) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL29486942 0.87 LMNA (0.63) ALDH1A1LMNAMAPTALOX15USP2
SCHEMBL26653683 0.87 LMNA (0.63) ALDH1A1LMNAMAPTALOX15USP2

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 ALDH1A1 3863/4885LMNA 1058/4885MAPT 214/4885

“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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