SCHEMBL2608568

SCHEMBL2608568

CC(=O)N1CCN(C(=O)[C@H](Cc2ccc(F)cc2)NC(=O)C2Cc3ccc(Cl)nc3N2)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 16/20 0.43
▸ MC5R P33032 8/20 0.43
▸ MC3R P41968 6/20 0.43
▸ MC1R Q01726 4/20 0.43
▸ PYGL P06737 1/20 0.42
▸ PYGM P11217 1/20 0.42
▸ CYP51A1 Q16850 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL13968044 0.90 PYGL (0.42) MC4RMC5RMC3RMC1RPYGL
SCHEMBL14400979 0.87 CYP51A1 (0.48) MC4RMC5RMC3RMC1RPYGL
SCHEMBL2606904 0.76 CYP51A1 (0.56) PYGLPYGMCYP51A1KMT2A
SCHEMBL13271677 0.75 MC4R (0.44) MC4RMC5RMC3RMC1RPYGL
SCHEMBL2608607 0.74 MMP9 (0.46) MC4RPYGL
SCHEMBL13271500 0.72 PYGL (0.41) MC4RMC5RMC3RMC1RPYGL
SCHEMBL13271678 0.72 CYP51A1 (0.48) MC4RMC5RMC3RMC1RPYGL
SCHEMBL2606799 0.70 CYP51A1 (0.56) PYGLPYGMCYP51A1KMT2A
SCHEMBL2606846 0.70 CYP51A1 (0.61) PYGLPYGMCYP51A1
SCHEMBL13271644 0.70 PYGL (0.41) MC4RMC5RMC3RMC1RPYGL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158622-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2012-04-17 — — US disclosed
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2009-01-22 — — 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-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB MC4R 4127/4885MC5R 4201/4885MC3R 4347/4885

“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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