SCHEMBL20108599

SCHEMBL20108599

C[C@@H](NC(=O)[C@H](CS)N1C(=O)N[C@@H](CC2CCCCC2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 6/20 0.51
▸ GHSR Q92847 3/20 0.51
▸ TUBB4A P04350 3/20 0.46
▸ TUBB P07437 3/20 0.46
▸ TUBA3C P0DPH7 3/20 0.46
▸ TUBA1B P68363 3/20 0.46
▸ TUBA4A P68366 3/20 0.46
▸ TUBB4B P68371 3/20 0.46
▸ TUBB3 Q13509 3/20 0.46
▸ TUBB2A Q13885 3/20 0.46
▸ TUBB8 Q3ZCM7 3/20 0.46
▸ TUBA3E Q6PEY2 3/20 0.46
▸ TUBA1A Q71U36 3/20 0.46
▸ TUBA1C Q9BQE3 3/20 0.46
▸ TUBB6 Q9BUF5 3/20 0.46
▸ TUBB2B Q9BVA1 3/20 0.46
▸ TUBB1 Q9H4B7 3/20 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
SCHEMBL23430230 0.97 MC4R (0.55) MC4RGHSR
SCHEMBL19334872 0.94 MC4R (0.53) MC4RGHSR
SCHEMBL23430156 0.93 MC4R (0.53) MC4RGHSR
SCHEMBL20108408 0.93 MC4R (0.54) MC4RGHSR
SCHEMBL20108360 0.90 MC4R (0.53) MC4RGHSR
SCHEMBL20108238 0.90 MC4R (0.56) MC4RGHSR
SCHEMBL19334897 0.89 MC4R (0.52) MC4RGHSR
SCHEMBL23430195 0.88 MC4R (0.55) MC4RGHSR
SCHEMBL20108332 0.87 MC4R (0.57) MC4RGHSR
SCHEMBL20108370 0.87 MC4R (0.57) MC4RGHSR

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-20180118784-A1 MELANOCORTIN RECEPTOR LIGANDS MODIFIED WITH HYDANTOIN IPSEN PHARMA S.A.S. (FR) 2018-05-03 — — 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-20180118784-A1 MELANOCORTIN RECEPTOR LIGANDS MODIFIED WITH HYDANTOIN MC4R, MC3R, MC1R MC4R 1/4885GHSR 103/4885TUBB4A 3303/4885

“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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