SCHEMBL29594305

SCHEMBL29594305

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 9/20 0.68
▸ CCKBR P32239 1/20 0.68
▸ ECE1 P42892 1/20 0.68
▸ MUS81 Q96NY9 1/20 0.68
▸ IL23R Q5VWK5 2/20 0.67
▸ PTH1R Q03431 7/20 0.67
▸ RXFP1 Q9HBX9 1/20 0.63
▸ KEAP1 Q14145 1/20 0.63
▸ GCGR P47871 1/20 0.63
▸ GIPR P48546 1/20 0.63

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
SCHEMBL29595353 0.94 GLP1R (0.67) GLP1RCCKBRECE1MUS81PTH1R
SCHEMBL29594176 0.93 RXFP1 (0.69) GLP1RCCKBRECE1MUS81IL23R
SCHEMBL31694503 0.93 PTH1R (0.72) GLP1RCCKBRECE1MUS81IL23R
SCHEMBL29595673 0.93 GLP1R (0.64) GLP1RCCKBRECE1MUS81IL23R
SCHEMBL29594048 0.91 GLP1R (0.62) GLP1RCCKBRECE1MUS81PTH1R
SCHEMBL31000919 0.91 GLP1R (0.76) GLP1RCCKBRECE1MUS81IL23R
SCHEMBL29429591 0.91 GLP1R (0.76) GLP1RCCKBRECE1MUS81PTH1R
SCHEMBL29365074 0.90 GLP1R (0.65) GLP1RCCKBRECE1MUS81IL23R
SCHEMBL29595296 0.90 GLP1R (0.64) GLP1RCCKBRECE1MUS81PTH1R
SCHEMBL29595262 0.90 GLP1R (0.64) GLP1RCCKBRECE1MUS81PTH1R

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-11312756-B2 Engineered potent cytotoxic stapled BH3 peptides THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2022-04-26 — — US claimed
US-11312756-B2 Engineered potent cytotoxic stapled BH3 peptides THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2022-04-26 — — 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-11312756-B2 Engineered potent cytotoxic stapled BH3 peptides BID, MCL1, BCL2L13 GLP1R 286/4885CCKBR 669/4885ECE1 2486/4885

“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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