SCHEMBL7562673

SCHEMBL7562673

CC(=O)OC(Cc1ccc2ccccc2c1)OC(=O)N1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 6/20 0.46
CCR1 P32246 3/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MCHR1 Q99705 1/20 0.41
OPRD1 P41143 1/20 0.41
MC4R P32245 2/20 0.40
MC3R P41968 2/20 0.40
MC1R Q01726 2/20 0.40
SLC18A3 Q16572 1/20 0.40
HRH3 Q9Y5N1 1/20 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
SCHEMBL6042950 0.89 CCR1 (0.44) FAAHCCR1ALDH1A1GAAMAPT
SCHEMBL6042262 0.87 FAAH (0.43) FAAHCCR1ALDH1A1GAAMAPT
SCHEMBL7562668 0.77 MCHR1 (0.40) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL2928091 0.69 FAAH (0.59) FAAHMAPTSMN1; SMN2MCHR1HRH3
SCHEMBL6043085 0.69 MCHR1 (0.41) CCR1ALDH1A1GAAMAPTRAB9A
SCHEMBL6042959 0.69 MCHR1 (0.41) CCR1ALDH1A1GAAMAPTRAB9A
SCHEMBL6042963 0.69 MCHR1 (0.41) CCR1ALDH1A1GAAMAPTRAB9A
SCHEMBL7745919 0.69 FAAH (0.55) FAAHCCR1ALDH1A1GAAMAPT
SCHEMBL6044326 0.68 MCHR1 (0.42) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL6044726 0.68 MCHR1 (0.42) ALDH1A1GAAMAPTRAB9ASMN1; SMN2

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
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed