SCHEMBL9622930

SCHEMBL9622930

CCCc1c(OCCCCOc2ccc(C(C)=O)c(OCCCC(=O)OCC)c2CCC)ccc(C(C)=O)c1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 15/20 0.77
CYSLTR1 Q9Y271 15/20 0.77
GRM2 Q14416 3/20 0.58
LMNA P02545 2/20 0.57
MEN1 O00255 1/20 0.57
GLA P06280 1/20 0.57
CYP3A4 P08684 1/20 0.57
ALOX5 P09917 1/20 0.57
ALOX15 P16050 1/20 0.57
TSHR P16473 1/20 0.57
PTGS1 P23219 1/20 0.57
PTGS2 P35354 1/20 0.57
KMT2A Q03164 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PPARG P37231 2/20 0.56
PPARD Q03181 2/20 0.56
PPARA Q07869 2/20 0.56
CYP1A2 P05177 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55

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
SCHEMBL10685273 0.99 CYSLTR2 (0.79) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL10688126 0.98 CYSLTR2 (0.78) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL9622859 0.98 CYSLTR2 (0.78) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL9623117 0.98 CYSLTR2 (0.75) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL10686482 0.97 CYSLTR2 (0.76) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL9622666 0.97 CYSLTR2 (0.77) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL10685724 0.95 CYSLTR2 (0.80) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL10689347 0.95 CYSLTR2 (0.80) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL10692942 0.95 CYSLTR2 (0.80) CYSLTR2CYSLTR1GRM2LMNAMEN1
SCHEMBL10687329 0.95 CYSLTR2 (0.80) CYSLTR2CYSLTR1GRM2LMNAMEN1

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
EP-0306959-B1 PHENOXYALKYLCARBOXYLIC ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATIONS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-01-02 EP disclosed
US-5023364-A Leukotriene antagonists, antiallergens KYORIN PHARMACEUTICAL CO., LTD. (JP) 1991-06-11 US disclosed
EP-0306959-A1 Phenoxyalkylcarboxylic acid derivatives and process for their preparations KYORIN PHARMACEUTICAL CO., LTD. (JP) 1989-03-15 EP disclosed