SCHEMBL10902255

SCHEMBL10902255

CCC=C(C)C(O)CCCC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.39
FFAR1 O14842 1/20 0.39
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
FDPS P14324 1/20 0.32
DNM1 Q05193 2/20 0.32
TRPA1 O75762 1/20 0.31
DDAH1 O94760 1/20 0.31
GAPDH P04406 1/20 0.31
MAPT P10636 1/20 0.31
CA2 P00918 2/20 0.31
MAPK1 P28482 1/20 0.31
CA1 P00915 1/20 0.30
SPHK1 Q9NYA1 1/20 0.30

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
SCHEMBL10902251 1.00 GPR84 (0.39) GPR84FFAR1ACHEBACE1ALDH1A1
SCHEMBL29473911 0.93 GPR84 (0.47) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL112320 0.93 GPR84 (0.47) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL10907236 0.91 GPR84 (0.50) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL10907234 0.91 GPR84 (0.50) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL10457066 0.91 GPR84 (0.50) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL10457057 0.91 GPR84 (0.50) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL10457067 0.91 GPR84 (0.50) GPR84FFAR1FDPSTRPA1DDAH1
SCHEMBL10457058 0.91 GPR84 (0.50) GPR84FFAR1FDPSTRPA1DDAH1
Alcohol SCHEMBL5314909 0.90 GPR84 (0.44) GPR84FFAR1TRPA1DDAH1GAPDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4482762-A UNSATURATED ACYCLIC ALCOHOL GIVAUDAN CORPORATION (US) 1984-11-13 US claimed
EP-0045453-B1 ALKENOLS (I) AND PROCESS FOR THEIR PREPARATION, UTILISATION OF (I) AS FRAGRANTS AND/OR AROMATIC COMPOUNDS, AS WELL AS A FRAGRANT AND/OR AROMATIC COMPOSITION CONTAINING (I) L. GIVAUDAN & CIE Société Anonyme (CH) 1984-02-15 EP claimed
EP-0045453-A1 Alkenols (I) and process for their preparation, utilisation of (I) as fragrants and/or aromatic compounds, as well as a fragrant and/or aromatic composition containing (I) L. GIVAUDAN & CIE Société Anonyme (CH) 1982-02-10 EP claimed
US-4585662-A Acyclic alcohol odorant and/or flavoring substances GIVAUDAN CORPORATION (US) 1986-04-29 US disclosed
US-4482762-A UNSATURATED ACYCLIC ALCOHOL GIVAUDAN CORPORATION (US) 1984-11-13 US disclosed
EP-0045453-B1 ALKENOLS (I) AND PROCESS FOR THEIR PREPARATION, UTILISATION OF (I) AS FRAGRANTS AND/OR AROMATIC COMPOUNDS, AS WELL AS A FRAGRANT AND/OR AROMATIC COMPOSITION CONTAINING (I) L. GIVAUDAN & CIE Société Anonyme (CH) 1984-02-15 EP disclosed
EP-0045453-A1 Alkenols (I) and process for their preparation, utilisation of (I) as fragrants and/or aromatic compounds, as well as a fragrant and/or aromatic composition containing (I) L. GIVAUDAN & CIE Société Anonyme (CH) 1982-02-10 EP disclosed