SCHEMBL23643256

SCHEMBL23643256

COC(=O)CCC(=O)NCc1ccc(CCNC(=O)[C@]2(C)CCCN2)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TPSAB1 Q15661 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ EPHX1 P07099 1/20 0.35

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
Hydrochloric Acid SCHEMBL31635871 0.78 KDM4E (0.40) ALDH1A1SMN1; SMN2HPGDHSD17B10EPHX1
Hydrochloric Acid SCHEMBL31635868 0.78 KDM4E (0.40) ALDH1A1SMN1; SMN2HPGDHSD17B10EPHX1
Hydrochloric Acid SCHEMBL31635867 0.78 KDM4E (0.40) ALDH1A1SMN1; SMN2HPGDHSD17B10EPHX1
SCHEMBL25499825 0.75 TLR7 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL19389996 0.70 LMNA (0.40) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL860798 0.69 TPSAB1 (0.54) ALDH1A1MEN1KMT2ATPSAB1
SCHEMBL1291594 0.69 HPGD (0.50) ALDH1A1MEN1KMT2AHPGDTAAR1
SCHEMBL1291430 0.68 TAAR1 (0.66) ALDH1A1MEN1KMT2AHPGDTAAR1
SCHEMBL16205822 0.68 TPSAB1 (0.57) ALDH1A1MEN1KMT2ATPSAB1
SCHEMBL16273562 0.67 HTT (0.59) ALDH1A1MEN1KMT2ATPSAB1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3810129-B1 PCSK9 ANTAGONIST BICYCLO-COMPOUNDS MERCK SHARP & DOHME LLC (US) 2023-08-16 — — EP disclosed
US-11306125-B2 PCSK9 antagonists bicyclo-compounds MERCK SHARP & DOHME CORP. (US) 2022-04-19 — — US disclosed
US-20210214395-A1 PCSK9 ANTAGONISTS BICYCLO-COMPOUNDS MERCK SHARP & DOHME LLC 2021-07-15 — — 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 (2 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-20210214395-A1 PCSK9 ANTAGONISTS BICYCLO-COMPOUNDS PCSK9, PCSK7, PCSK6 ALDH1A1 4478/4885MEN1 2467/4885KMT2A 2571/4885
US-11306125-B2 PCSK9 antagonists bicyclo-compounds PCSK9, PCSK7, PCSK6 ALDH1A1 4478/4885MEN1 2467/4885KMT2A 2571/4885

“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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