SCHEMBL9655849

SCHEMBL9655849

CCCCCCCCCCC(C)C1CC2OC2CC1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.37
GPR84 Q9NQS5 6/20 0.37
FFAR1 O14842 1/20 0.37
ACE P12821 2/20 0.36
MAPT P10636 1/20 0.36
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 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
SCHEMBL21168501 0.88 ACE2 (0.43) ACE2GPR84FFAR1MAPTLCK
SCHEMBL22548606 0.75 ACE2 (0.40) ACE2GPR84FFAR1ACEMAPT
SCHEMBL28779796 0.71 PPM1B (0.47)
SCHEMBL16415728 0.71 PPM1B (0.47)
SCHEMBL7360984 0.69 GPR84 (0.43) ACE2GPR84FFAR1MAPTLCK
SCHEMBL28869705 0.67 S1PR5 (0.41) ACE
SCHEMBL123577 0.66 NAAA (0.52)
SCHEMBL9656347 0.66 NAAA (0.52)
SCHEMBL9655845 0.66 NAAA (0.52)
SCHEMBL9188266 0.66 NAAA (0.52)

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-0479166-A1 Transesterification process for preparation of cycloaliphatic epoxides UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1992-04-08 EP disclosed