SCHEMBL23318156

SCHEMBL23318156

N=C(N)NCCC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)CCCNC1=O

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.64
OPRD1 P41143 1/20 0.64
MC3R P41968 13/20 0.55
MC4R P32245 13/20 0.55
MC5R P33032 12/20 0.55
MC1R Q01726 10/20 0.50
ITGB3 P05106 1/20 0.50
ITGAV P06756 1/20 0.50
ITGA2B P08514 1/20 0.50
TACR2 P21452 1/20 0.49
KRAS P01116 1/20 0.48
KDM4A O75164 1/20 0.47
KLKB1 P03952 1/20 0.46

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
SCHEMBL19831554 0.98 OPRM1 (0.61) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL23317973 0.97 OPRM1 (0.58) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL13478156 0.88 OPRM1 (0.61) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL12706706 0.88 OPRM1 (0.61) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL13739916 0.88 OPRM1 (0.61) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL29924992 0.86 MC4R (0.58) MC3RMC4RMC5RMC1RTACR2
SCHEMBL29924705 0.85 MC4R (0.57) MC3RMC4RMC5RMC1RTACR2
SCHEMBL30169340 0.84 HDAC3 (0.59) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL29664052 0.82 MC3R (0.80) OPRM1OPRD1MC3RMC4RMC5R
SCHEMBL13121283 0.82 MEN1 (0.56) MC3RMC4RMC5RMC1RKLKB1

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-20210130409-A1 Method for the Solid-Phase Synthesis of Cyclic Pentapeptides Alsonex Pty Ltd (AU) 2021-05-06 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-20210130409-A1 Method for the Solid-Phase Synthesis of Cyclic Pentapeptides ARG1, PNISR, HRH3 OPRM1 715/4885OPRD1 701/4885MC3R 489/4885

“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.