SCHEMBL9754040

SCHEMBL9754040

CCCc1c([O])ccc(C(C)=O)c1OC

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 12/20 0.45
CYSLTR1 Q9Y271 12/20 0.45
LTB4R Q15722 3/20 0.43
LTB4R2 Q9NPC1 2/20 0.43
CTSD P07339 2/20 0.41
PPARG P37231 2/20 0.38
PPARD Q03181 2/20 0.38
PPARA Q07869 2/20 0.38
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
NFKB1 P19838 1/20 0.37
BLM P54132 1/20 0.37
GRM2 Q14416 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
SCHEMBL7046976 0.84 CYSLTR2 (0.45) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL6932259 0.78 PPARG (0.48) CYSLTR2CYSLTR1PPARGPPARDPPARA
SCHEMBL10978263 0.75 LTB4R (0.47) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL9042851 0.75 LTB4R (0.57) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL8777250 0.75 LTB4R (0.57) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL10455677 0.73 CYSLTR2 (0.37) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
Ethylene SCHEMBL8977854 0.73 LTB4R (0.55) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL2007148 0.73 LTB4R (0.41) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL16576614 0.72 CYSLTR2 (0.46) CYSLTR2CYSLTR1LTB4RLTB4R2CTSD
SCHEMBL7252527 0.71 BRD4 (0.39) LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991017989-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF G.D. SEARLE & CO. (US) 1991-11-28 WO disclosed