SCHEMBL7562668

SCHEMBL7562668

CC(=O)OC(Cc1ccc2ccccc2c1)C1CC(c2ccc(F)cc2)CCN1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.40
MC3R P41968 8/20 0.39
MC4R P32245 7/20 0.39
MC1R Q01726 7/20 0.39
TACR1 P25103 1/20 0.38
SLC18A3 Q16572 1/20 0.37
CCR3 P51677 1/20 0.37
OPRD1 P41143 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6042959 0.90 MCHR1 (0.41) MCHR1MC3RMC4RMC1RTACR1
SCHEMBL6042963 0.90 MCHR1 (0.41) MCHR1MC3RMC4RMC1RTACR1
SCHEMBL6043085 0.90 MCHR1 (0.41) MCHR1MC3RMC4RMC1RTACR1
SCHEMBL6044726 0.88 MCHR1 (0.42) MCHR1MC3RMC4RMC1RTACR1
SCHEMBL6044326 0.88 MCHR1 (0.42) MCHR1MC3RMC4RMC1RTACR1
SCHEMBL6042254 0.88 MCHR1 (0.42) MCHR1MC3RMC4RMC1RTACR1
SCHEMBL7562673 0.77 FAAH (0.46) MCHR1MC3RMC4RMC1RSLC18A3
SCHEMBL6042262 0.70 FAAH (0.43) MCHR1SLC18A3ALDH1A1GAAMAPT
SCHEMBL6042950 0.70 CCR1 (0.44) MCHR1TACR1CCR3ALDH1A1GAA
Trifluoroacetic Acid SCHEMBL6041683 0.70 REN (0.46)

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