SCHEMBL8022977

SCHEMBL8022977

CC(C)CCN(CCC(C)C)C(=O)c1ccc2nc(-c3cnc4c(c3)OCCN4C)c(CCCN3CCCC3)n2c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 19/20 0.41
▸ MC5R P33032 3/20 0.39
▸ MC3R P41968 3/20 0.39
▸ SLC2A1 P11166 1/20 0.39
▸ MC1R Q01726 2/20 0.38

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
SCHEMBL8039020 0.92 SLC2A1 (0.46) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL12990184 0.89 MC4R (0.43) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL11929574 0.81 MC4R (0.47) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL11929564 0.81 MC4R (0.50) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL13034253 0.81 SLC2A1 (0.49) MC4RMC5RMC3RSLC2A1
SCHEMBL11929587 0.80 MC4R (0.43) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL11929590 0.80 MC4R (0.42) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL11929586 0.79 MC4R (0.52) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL4669868 0.79 MC4R (0.45) MC4RMC5RMC3RSLC2A1MC1R
SCHEMBL11929584 0.79 MC4R (0.45) MC4RMC5RMC3RSLC2A1MC1R

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
WO-2009080291-A1 SUBSTITUTED IMIDAZOPYRIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR ANTAGONISTS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2009-07-02 — — WO disclosed
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