SCHEMBL1920168

SCHEMBL1920168

CCN1C[C@@H](C(=O)OC)[C@H](c2ccc(F)cc2F)C1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MC4R P32245 19/20 0.58
MC5R P33032 5/20 0.57
MC1R Q01726 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
MC3R P41968 3/20 0.39
KCNH2 Q12809 2/20 0.39

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
SCHEMBL18914400 0.86 MC4R (0.52) MC4RMC5RMC1R
SCHEMBL18914407 0.86 MC4R (0.52) MC4RMC5RMC1R
SCHEMBL3170726 0.86 MC4R (0.61) MC4RMC5RMC1RMC3RKCNH2
SCHEMBL3170723 0.86 MC4R (0.61) MC4RMC5RMC1RMC3RKCNH2
SCHEMBL29327391 0.85 MC1R (0.51) MC4RMC5RMC1R
SCHEMBL1920165 0.85 MC1R (0.51) MC4RMC5RMC1R
Hydrochloric Acid SCHEMBL1920194 0.85 MC4R (0.63) MC4RMC5RMC1RMC3RKCNH2
Hydrochloric Acid SCHEMBL3170453 0.85 MC4R (0.63) MC4RMC5RMC1RMC3RKCNH2
SCHEMBL1920357 0.84 MC4R (0.56) MC4RMC5R
SCHEMBL18914401 0.83 MC4R (0.47) MC4RMC5RMC1R

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
EP-1716135-B1 PIPERIDINYLCARBONYL-PYRROLIDINES AND THEIR USE AS MELANOCORTIN AGONISTS PFIZER LTD (GB) 2011-06-01 EP disclosed
US-7649002-B2 (3,5-dimethylpiperidin-1yl)(4-phenylpyrrolidin-3-yl)methanone derivatives as MCR4 agonists PFIZER INC (US) 2010-01-19 US disclosed