SCHEMBL1920357

SCHEMBL1920357

COC(=O)[C@@H]1CN(C)C[C@H]1c1ccc(F)cc1F

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MC4R P32245 3/20 0.56
MC5R P33032 2/20 0.56
SLC6A2 P23975 5/20 0.46
SLC6A4 P31645 5/20 0.46
SLC6A3 Q01959 5/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL1920280 0.85 MC4R (0.60) MC4RMC5RMEN1KMT2A
SCHEMBL1920425 0.85 MC4R (0.60) MC4RMC5RMEN1KMT2A
SCHEMBL1920168 0.84 MC4R (0.58) MC4RMC5R
SCHEMBL1920864 0.84 MC4R (0.59) MC4RMC5R
SCHEMBL18914642 0.84 MC4R (0.59) MC4RMC5R
SCHEMBL1920254 0.84 MC4R (0.59) MC4RMC5R
SCHEMBL18914407 0.82 MC4R (0.52) MC4RMC5R
SCHEMBL18914400 0.82 MC4R (0.52) MC4RMC5R
SCHEMBL18914417 0.80 PDE4B (0.59) MC4RMC5R
SCHEMBL18914504 0.80 MC4R (0.48) MC4RMC5R

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 4 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
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
US-7649002-B2 (3,5-dimethylpiperidin-1yl)(4-phenylpyrrolidin-3-yl)methanone derivatives as MCR4 agonists PFIZER INC (US) 2010-01-19 US disclosed