SCHEMBL14215855

SCHEMBL14215855

CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCC(N)=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)NC(C(=O)NCC(N)=O)c1c[nH]c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 9/20 0.59
▸ GHSR Q92847 4/20 0.50
▸ NPY2R P49146 3/20 0.50
▸ MC5R P33032 1/20 0.49
▸ MC3R P41968 1/20 0.49
▸ MC1R Q01726 1/20 0.49
▸ IL23R Q5VWK5 3/20 0.48
▸ NR3C1 P04150 2/20 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
SCHEMBL14188828 0.92 MC4R (0.68) MC4RGHSRNPY2RMC5RMC3R
SCHEMBL13035278 0.89 MC4R (0.68) MC4RGHSRNPY2RMC5RMC3R
SCHEMBL29357687 0.82 KISS1R (0.62) MC4RMC5RMC3RMC1R
SCHEMBL1449964 0.81 IL23R (0.56) MC4RMC1RIL23R
SCHEMBL306027 0.81 IL23R (0.56) MC4RMC1RIL23R
SCHEMBL14511692 0.79 MC4R (0.71) MC4RGHSRNPY2RIL23R
SCHEMBL25767621 0.78 MC4R (0.66) MC4RGHSRMC5RMC3RMC1R
SCHEMBL28714609 0.78 IL23R (0.56) MC4RMC1RIL23R
SCHEMBL14511696 0.77 MC4R (0.67) MC4RGHSRNPY2RIL23R
SCHEMBL23483109 0.76 MC4R (0.71) MC4RGHSRIL23R

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-20080108641-A1 Compounds for treating inflammatory disorders, demyelinating disdorders and cancers XANTHUS PHARMACEUTICALS, INC. 2008-05-08 — — 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-20080108641-A1 Compounds for treating inflammatory disorders, demyelinating disdorders and cancers PMP22, PML, AQP4 MC4R 2878/4885GHSR 4049/4885NPY2R 4594/4885

“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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