SCHEMBL17152259

SCHEMBL17152259

CCN(CC)CCC[C@H](C)NC(=O)[CH]CC(C)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
FPR3 P25089 1/20 0.36
FPR2 P25090 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CACNA2D1 P54289 6/20 0.32
HRH3 Q9Y5N1 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TLR2 O60603 1/20 0.30
METAP2 P50579 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
PAOX Q6QHF9 1/20 0.30

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
SCHEMBL17152234 0.80 ALDH1A1 (0.48) LMNAFPR3FPR2ALDH1A1NPSR1
SCHEMBL17152606 0.78 MMP1 (0.39) ALDH1A1MEN1KMT2A
SCHEMBL4997614 0.77 LMNA (0.48) LMNAFPR3FPR2ALDH1A1MEN1
SCHEMBL17152161 0.74 KDM1A (0.31)
SCHEMBL17152493 0.73 MLYCD (0.33) ALDH1A1
SCHEMBL14065568 0.73 LMNA (0.52) LMNAFPR3FPR2ALDH1A1MEN1
SCHEMBL12507020 0.73 LMNA (0.52) LMNAFPR3FPR2ALDH1A1MEN1
SCHEMBL17152577 0.71 CA12 (0.36) LMNA
SCHEMBL12414328 0.71 LMNA (0.51) LMNAFPR3FPR2ALDH1A1MEN1
SCHEMBL17152507 0.71 HPGD (0.36) LMNAALDH1A1MEN1KMT2A

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-2897939-B1 BENZOIMIDAZOLE-CARBOXYLIC ACID AMIDE DERIVATIVES FOR TREATING METABOLIC OR CARDIOVASCULAR DISEASES SANOFI SA (FR) 2017-02-01 EP disclosed
US-9156796-B2 Benzoimidazole-carboxylic acid amide derivatives as APJ receptor modulators SANOFI (FR) 2015-10-13 US disclosed