SCHEMBL9487173

SCHEMBL9487173

CCCCCCCCCCC(O)C#CC#CC#CC#CC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.57
GPR84 Q9NQS5 8/20 0.47
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.43
MAPT P10636 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
ACE2 Q9BYF1 1/20 0.40

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
SCHEMBL8971535 0.85 GPR84 (0.53) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL29211086 0.85 GPR84 (0.53) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL8985101 0.85 GPR84 (0.53) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL8971531 0.85 GPR84 (0.53) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL29211102 0.85 GPR84 (0.53) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL29155448 0.85 HMGCR (0.46) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL29211129 0.83 GPR84 (0.50) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL30629423 0.77 HMGCR (0.54) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL27386281 0.77 CA2 (0.43) HMGCRGPR84FFAR1FFAR4MAPT
SCHEMBL735733 0.74 GPR84 (0.50) HMGCRGPR84FFAR1FFAR4MAPT

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
US-5268494-A Compound containing conjugated triple bonds CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1993-12-07 US disclosed
US-5151534-A Antiallergens, antiinflammatory agents or skin disorders CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD) (FR) 1992-09-29 US disclosed