SCHEMBL30028306

SCHEMBL30028306

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.46
▸ REN P00797 10/20 0.43
▸ NTSR2 O95665 2/20 0.43
▸ NTSR1 P30989 1/20 0.41
▸ GRB2 P62993 1/20 0.41
▸ NTMT1 Q9BV86 1/20 0.41
▸ F2 P00734 1/20 0.41

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
SCHEMBL30029328 0.94 KDM1A (0.42) OPRM1RENNTSR2NTMT1
SCHEMBL31399255 0.91 REN (0.44) OPRM1RENNTSR2GRB2NTMT1
SCHEMBL29962469 0.91 REN (0.44) OPRM1RENNTSR2NTMT1F2
SCHEMBL29669249 0.90 REN (0.45) OPRM1RENNTSR2GRB2F2
SCHEMBL30937369 0.89 REN (0.43) OPRM1RENNTSR2GRB2F2
SCHEMBL29658176 0.89 GRB2 (0.44) OPRM1RENNTSR2NTSR1GRB2
SCHEMBL29350551 0.87 GRB2 (0.56) NTSR2NTSR1GRB2F2
SCHEMBL28758609 0.87 REN (0.44) OPRM1RENGRB2F2
SCHEMBL29801925 0.86 REN (0.45) RENNTSR2NTSR1GRB2F2
SCHEMBL29679576 0.86 GHSR (0.42) —

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-20220339239-A1 USE OF MELANOCORTINS TO TREAT INSULIN SENSITIVITY IPSEN PHARMA SAS (FR) 2022-10-27 — — 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-20220339239-A1 USE OF MELANOCORTINS TO TREAT INSULIN SENSITIVITY MC4R, MC1R, MC3R OPRM1 216/4885REN 281/4885NTSR2 28/4885

“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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