SCHEMBL12057583

SCHEMBL12057583

CC(=O)NC(Cc1c[nH]cn1)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 6/20 0.64
▸ KISS1R Q969F8 11/20 0.58
▸ CTSL P07711 1/20 0.53
▸ CTSH P09668 1/20 0.53
▸ CTSS P25774 1/20 0.53
▸ CTSK P43235 1/20 0.53

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
SCHEMBL29420167 1.00 MC4R (0.64) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL30418415 0.94 MC4R (0.58) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL12094757 0.94 MC4R (0.58) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL12094755 0.94 MC4R (0.58) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL12094764 0.94 MC4R (0.58) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL12094797 0.94 MC4R (0.58) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL12094801 0.94 MC4R (0.58) MC4RKISS1RCTSLCTSHCTSS
SCHEMBL29862114 0.94 KISS1R (0.59) MC4RKISS1R
SCHEMBL29862312 0.94 KISS1R (0.59) MC4RKISS1R
SCHEMBL29862360 0.94 KISS1R (0.59) MC4RKISS1R

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-20110319274-A1 Identification of Compounds Modifying a Cellular Response CARLSBERG A/S (DK) 2011-12-29 — — 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-20110319274-A1 Identification of Compounds Modifying a Cellular Response MYD88, CD14, STAT1 MC4R 3747/4885KISS1R 4736/4885CTSL 1427/4885

“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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