SCHEMBL23642940

SCHEMBL23642940

COC(=O)CCC(=O)NCc1ccc(CCNC(=O)[C@]2(C)CCCN2C(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)[C@@H](N)[C@@H](C)OC(C)(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.34
▸ HTRA1 Q92743 1/20 0.34
▸ MMP1 P03956 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CAPN1 P07384 1/20 0.33
▸ CHRM5 P08912 1/20 0.33
▸ CHRM3 P20309 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MMP2 P08253 1/20 0.32
▸ MMP3 P08254 1/20 0.32

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
SCHEMBL23080795 0.84 FOLH1 (0.30) —
SCHEMBL25500051 0.84 MMP1 (0.39) KMT2AMMP1MMP3
SCHEMBL23080559 0.82 MMP1 (0.39) KMT2AMMP1MMP3
SCHEMBL23080567 0.82 MMP1 (0.39) MMP1MMP2MMP3
SCHEMBL25495899 0.79 CAPN1 (0.33) KMT2AMMP1ALDH1A1CAPN1MEN1
SCHEMBL25501433 0.79 PSMB5 (0.33) HTRA1ALDH1A1LMNA
SCHEMBL25968542 0.78 ALDH1A1 (0.32) KMT2AALDH1A1POLBLMNACHRM5
SCHEMBL31635869 0.75 ALDH1A1 (0.42) KMT2AHTRA1ALDH1A1LMNACHRM5
SCHEMBL25500045 0.73 MMP1 (0.40) MMP1MMP2MMP3
SCHEMBL25444781 0.73 MMP1 (0.42) KMT2AMMP1MMP2MMP3

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 KMT2A 2571/4885HTRA1 1060/4885MMP1 2356/4885
US-11306125-B2 PCSK9 antagonists bicyclo-compounds PCSK9, PCSK7, PCSK6 KMT2A 2571/4885HTRA1 1060/4885MMP1 2356/4885

“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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