SCHEMBL11530558

SCHEMBL11530558

C=C(C(=O)O)C(CCCCC)N1CC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.39
FFAR1 O14842 2/20 0.39
MAPT P10636 2/20 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
DRD3 P35462 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CA1 P00915 1/20 0.35

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
SCHEMBL525070 0.95 SIGMAR1 (0.40) GPR84MAPTDRD3SIGMAR1MAPK1
SCHEMBL4625385 0.80 SIGMAR1 (0.36) DRD3SIGMAR1SLC6A2SLC6A3CA1
SCHEMBL10336334 0.78 ALDH1A1 (0.38) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28441307 0.75 GPR84 (0.41) GPR84FFAR1MAPTLCKPPARD
SCHEMBL11847858 0.75 MAPT (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5986618 0.75 GPR84 (0.46) GPR84FFAR1MAPTLCKPPARD
SCHEMBL22433662 0.74 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9421724 0.74 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3321348 0.74 GRIK1 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28687392 0.72 MAPT (0.49) GPR84FFAR1MAPTLCKPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4148981-A Dithiophosphorylated copolymers of aziridineethyl acrylates or methacrylates and alkyl acrylates or methacrylates GULF RESEARCH & DEVELOPMENT COMPANY (US) 1979-04-10 US claimed
US-4136042-A EXTREME PRESSURE LUBRICANTS GULF RESEARCH & DEVELOPMENT COMPANY (US) 1979-01-23 US claimed
US-4148981-A Dithiophosphorylated copolymers of aziridineethyl acrylates or methacrylates and alkyl acrylates or methacrylates GULF RESEARCH & DEVELOPMENT COMPANY (US) 1979-04-10 US disclosed