SCHEMBL5603385

SCHEMBL5603385

CCCCCCCCCC(CCC=O)C(C)(C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
FFAR1 O14842 2/20 0.41
FDPS P14324 1/20 0.40
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
FFAR4 Q5NUL3 2/20 0.39
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
HSPD1 P10809 1/20 0.39
BLM P54132 1/20 0.39
HSPE1 P61604 1/20 0.39
CA2 P00918 1/20 0.39
GRIK1 P39086 1/20 0.38
GRIK2 Q13002 1/20 0.38
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL5603668 1.00 TSHR (0.42) TSHRGPR84FFAR1FDPSMAPT
SCHEMBL688517 0.88 GPR84 (0.50) GPR84FFAR1FDPSMAPTLCK
SCHEMBL5702669 0.88 GPR84 (0.50) GPR84FFAR1FDPSMAPTLCK
SCHEMBL23197897 0.86 FDPS (0.52) GPR84FFAR1FDPSMAPTLCK
Ammonia Solution, Strong SCHEMBL28463038 0.86 GPR84 (0.48) GPR84FFAR1FDPSMAPTLCK
SCHEMBL27396178 0.84 GPR84 (0.47) GPR84FFAR1FDPSMAPTLCK
Ammonia Solution, Strong SCHEMBL27256295 0.83 GPR84 (0.46) GPR84FFAR1FDPSMAPTLCK
SCHEMBL2895726 0.81 ACE2 (0.44) GPR84FFAR1FDPSMAPTLCK
SCHEMBL22181478 0.81 GPR84 (0.47) GPR84FFAR1FDPSMAPTLCK
Ammonia Solution, Strong SCHEMBL27753603 0.80 GPR84 (0.43) GPR84FFAR1FDPSMAPTLCK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1527044-B1 POLYALDIMINES SIKA TECHNOLOGY AG (CH) 2007-11-14 EP disclosed
EP-1384709-A1 Polyaldimines Sika Technology AG (CH) 2004-01-28 EP disclosed