SCHEMBL5233583

SCHEMBL5233583

CC(=O)C1(NCC2CC2)CN(c2ccc(-c3ccc(C(F)(F)F)cc3)cn2)CCN1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
DGAT1 O75907 11/20 0.40
KCNH2 Q12809 7/20 0.40
CYP2C9 P11712 3/20 0.40
CYP3A4 P08684 2/20 0.40
ADORA2A P29274 1/20 0.40
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
MGLL Q99685 1/20 0.39
HSD11B1 P28845 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 1/20 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
SCHEMBL5236231 0.89 MAPT (0.43) MAPTKDM4EDGAT1KCNH2CYP2C9
SCHEMBL5238349 0.86 MAPT (0.45) MAPTKDM4EDGAT1KCNH2CYP2C9
SCHEMBL5233805 0.84 PANK3 (0.39) CKS1BSKP1SKP2
SCHEMBL5233588 0.83 DGAT1 (0.41) CKS1BSKP1SKP2MAPTKDM4E
SCHEMBL5237578 0.81 KDM4E (0.43) MAPTKDM4EDGAT1KCNH2MGLL
SCHEMBL5233237 0.79 SMN1; SMN2 (0.44) MAPTKDM4EDGAT1KCNH2CYP2C9
SCHEMBL5237020 0.77 MGLL (0.47) MAPTKDM4EDGAT1KCNH2MGLL
SCHEMBL5238939 0.75 MCHR1 (0.39) CHRM2CHRM1
SCHEMBL5236239 0.75 SMN1; SMN2 (0.41) MAPTKDM4EDGAT1KCNH2CYP2C9
SCHEMBL5238354 0.74 MAPT (0.40) MAPTKDM4EDGAT1KCNH2CYP2C9

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
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed