SCHEMBL5215247

SCHEMBL5215247

CC(C)(C)CCCC(C)(C)CC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.46
CPT2 P23786 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL5521030 0.86 FFAR1 (0.62) FFAR1CPT2TDP1KDM4E
SCHEMBL6667493 0.82 FFAR1 (0.52) FFAR1CPT2TDP1KDM4E
SCHEMBL18760169 0.78 FFAR1 (0.54) FFAR1CPT2TDP1
SCHEMBL16280996 0.77 KDM4E (0.42) FFAR1CPT2TDP1KDM4E
SCHEMBL1578074 0.76 LMNA (0.43) FFAR1CPT2TDP1KDM4E
SCHEMBL21626032 0.76 FFAR1 (0.39) FFAR1CPT2TDP1KDM4E
SCHEMBL8965 0.75 SOAT1 (0.37) FFAR1CPT2TDP1KDM4E
SCHEMBL27312675 0.74 FFAR1 (0.43) FFAR1CPT2TDP1
SCHEMBL7083891 0.73 KDM4E (0.36) FFAR1CPT2TDP1KDM4E
SCHEMBL9065 0.73 KMT2A (0.40) FFAR1CPT2TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773338-A4 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO INC (US) 2007-08-01 EP disclosed
EP-1773338-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS Merck & Co., Inc. (US) 2007-04-18 EP disclosed
WO-2006020277-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2006-02-23 WO disclosed