SCHEMBL18723218

SCHEMBL18723218

CCCCCCC(/C=C/C(=O)OCC)CCCCCC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.45
ATM Q13315 1/20 0.44
ZDHHC7 Q9NXF8 1/20 0.42
MAPT P10636 2/20 0.41
GPR84 Q9NQS5 4/20 0.39
FFAR1 O14842 1/20 0.39
FAAH O00519 3/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL30914719 1.00 HCAR2 (0.45) HCAR2ATMZDHHC7MAPTGPR84
SCHEMBL21694608 1.00 HCAR2 (0.45) HCAR2ATMZDHHC7MAPTGPR84
SCHEMBL25808263 0.98 HCAR2 (0.44) HCAR2ATMZDHHC7MAPTGPR84
SCHEMBL22627138 0.98 HCAR2 (0.46) HCAR2ATMZDHHC7MAPTGPR84
SCHEMBL22465645 0.98 HCAR2 (0.46) HCAR2ATMZDHHC7MAPTGPR84
SCHEMBL30914726 0.87 ACHE (0.43) HCAR2ATMZDHHC7MAPT
SCHEMBL6476706 0.86 TSHR (0.46) HCAR2ATMMAPTALDH1A1
SCHEMBL6476703 0.86 TSHR (0.46) HCAR2ATMMAPTALDH1A1
SCHEMBL29001105 0.85 TRPA1 (0.50) HCAR2ATMMAPTGPR84FFAR1
SCHEMBL22005512 0.84 ZDHHC7 (0.47) HCAR2ZDHHC7MAPTGPR84FFAR1

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
US-9616099-B2 Cyclosporin analogues for preventing or treating hepatitis C infection ENANTA PHARMACEUTICALS, INC. (US) 2017-04-11 US disclosed