SCHEMBL9151390

SCHEMBL9151390

CCCCCC(C(=O)O)[N+]1([O-])CCCC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.44
FFAR1 O14842 1/20 0.44
MAPT P10636 1/20 0.43
LCK P06239 1/20 0.43
PPARD Q03181 1/20 0.43
ZDHHC20 Q5W0Z9 1/20 0.43
ZDHHC2 Q9UIJ5 1/20 0.43
ACE2 Q9BYF1 1/20 0.41
CA1 P00915 2/20 0.40
GRIK1 P39086 2/20 0.39
GRIK2 Q13002 2/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
CA2 P00918 2/20 0.38
MAPK1 P28482 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
SCHEMBL9155296 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9148973 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9147469 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9150501 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9154592 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9152073 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9147371 0.98 GPR84 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL6668221 0.70 LMNA (0.33) GPR84FFAR1CA1CA2
SCHEMBL17797108 0.69 LMNA (0.41) CA2
Cyclohexane SCHEMBL28302400 0.67 ACE2 (0.68) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5470848-A Penetration enhancers for transdermal delivery of systemic agents DISCOVERY THERAPEUTICS, INC. 1995-11-28 US claimed
US-5472946-A Topical administration of lincomycin, clindamycin, erthromycin and iododeoxyuridine on skin or mucuous membranes DISCOVERY THERAPEUTICS, INC. 1995-12-05 US disclosed
US-5470848-A Penetration enhancers for transdermal delivery of systemic agents DISCOVERY THERAPEUTICS, INC. 1995-11-28 US disclosed
US-5444075-A Penetration enhancers for transdermal delivery of systemic agents MINASKANIAN GEVORK (US) 1995-08-22 US disclosed
US-5118676-A Administering carboxylic derivatives as enhancer with systemically active agents WHITBY RESEARCH, INC. (US) 1992-06-02 US disclosed
US-5118692-A Penetration enhances for transdermal delivery of systemic agents WHITBY RESEARCH, INC. (US) 1992-06-02 US disclosed
US-4996199-A Penetration enhancers for transdermal delivery of systemic agents WHITBY RESEARCH, INC. (US) 1991-02-26 US disclosed