SCHEMBL11238181

SCHEMBL11238181

CCCCCCCCCCCCC(CCCCCCCCCCCCCCC(C(=O)O)C(C)C)(C(=O)O)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.42
GPR84 Q9NQS5 7/20 0.42
FFAR1 O14842 1/20 0.42
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
HSPD1 P10809 1/20 0.40
BLM P54132 1/20 0.40
HSPE1 P61604 1/20 0.40
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL8012921 0.84 ACE2 (0.43) ACE2GPR84FFAR1MAPTLCK
SCHEMBL8029009 0.84 ACE2 (0.43) ACE2GPR84FFAR1MAPTLCK
SCHEMBL635007 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL2830699 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL26421 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL9216782 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL2895895 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL503120 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL10786248 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK
SCHEMBL2829338 0.83 GPR84 (0.57) ACE2GPR84FFAR1MAPTLCK

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-0050782-A1 Pet collars containing ectoparasiticides BAYER AG (DE) 1982-05-05 EP disclosed