SCHEMBL12767725

SCHEMBL12767725

CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C)C(=O)N[C@@H](C(=O)NCC(=O)N[C@H](Cc1c[nH]cn1)C(=O)NC(CC(C)C)C(O)CC(=O)N[C@H](CC(C)C)C(N)=O)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GRPR P30550 10/20 0.58
▸ REN P00797 6/20 0.55
▸ NMBR P28336 2/20 0.49
▸ NPBWR1 P48145 1/20 0.47

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
SCHEMBL16716014 0.94 GRPR (0.57) GRPRRENNMBR
SCHEMBL29473455 0.94 GRPR (0.57) GRPRRENNPBWR1
SCHEMBL27378954 0.93 GRPR (0.69) GRPRNMBR
SCHEMBL27379518 0.93 GRPR (0.69) GRPRNMBR
SCHEMBL30118088 0.91 GRPR (0.62) GRPRRENNMBR
SCHEMBL17120941 0.91 GRPR (0.62) GRPRNMBR
SCHEMBL30398505 0.90 GRPR (0.64) GRPRNMBR
SCHEMBL29484954 0.90 GRPR (0.67) GRPRNMBR
SCHEMBL29484960 0.90 GRPR (0.67) GRPRNMBR
SCHEMBL31494985 0.89 REN (0.53) GRPRRENNPBWR1

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-9035023-B2 Bombesin analog peptide antagonist conjugates Piramal Imaging, SA (CH) 2015-05-19 — — US disclosed
US-20110097266-A1 Bombesin Analog Peptide Antagonist Conjugates BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-04-28 — — 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-20110097266-A1 Bombesin Analog Peptide Antagonist Conjugates BRS3, VIP, GRPR GRPR 3/4885REN 1533/4885NMBR 33/4885

“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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