SCHEMBL17120941

SCHEMBL17120941

CC(=O)NC(C(=O)N[C@H](CCC(N)=O)C(=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)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRPR P30550 15/20 0.62
▸ NMBR P28336 1/20 0.51

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
SCHEMBL27379518 0.94 GRPR (0.69) GRPRNMBR
SCHEMBL27378954 0.94 GRPR (0.69) GRPRNMBR
SCHEMBL29484960 0.92 GRPR (0.67) GRPRNMBR
SCHEMBL29484954 0.92 GRPR (0.67) GRPRNMBR
SCHEMBL30398505 0.92 GRPR (0.64) GRPRNMBR
SCHEMBL12767725 0.91 GRPR (0.58) GRPRNMBR
SCHEMBL24253291 0.91 GRPR (0.69) GRPRNMBR
SCHEMBL25081959 0.91 GRPR (0.69) GRPRNMBR
SCHEMBL25081963 0.91 GRPR (0.69) GRPRNMBR
SCHEMBL24253292 0.91 GRPR (0.69) GRPRNMBR

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-20150265733-A1 BOMBESIN ANALOG PEPTIDE ANTAGONIST CONJUGATES Universität Bern (CH) 2015-09-24 — — 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-20150265733-A1 BOMBESIN ANALOG PEPTIDE ANTAGONIST CONJUGATES BRS3, VIP, GRPR GRPR 3/4885NMBR 34/4885

“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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