SCHEMBL11064032

SCHEMBL11064032

CCCC(=O)c1ccc2[nH]c(C(=O)O)cc(=O)c2c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 4/20 0.52
NGFR P08138 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
AHR P35869 1/20 0.43
CHRNA7 P36544 1/20 0.43
KMT2A Q03164 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43

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
SCHEMBL11065351 0.88 GPR35 (0.39) GPR35ALDH1A1HPGDHSD17B10
SCHEMBL11069218 0.86 KDM4E (0.48) KDM4EMEN1ALDH1A1GLAGAA
SCHEMBL11263377 0.85 ALDH1A1 (0.45) KDM4EMEN1ALDH1A1CYP1A2GAA
SCHEMBL11261165 0.81 GABRA1 (0.38) GPR35KDM4EMEN1ALDH1A1HPGD
SCHEMBL11075982 0.76 KDM4E (0.46) GPR35NGFRKDM4EMEN1GRIN2D
SCHEMBL11065167 0.74 GPR35 (0.64) GPR35NGFRKDM4EMEN1GRIN2D
SCHEMBL9452297 0.70 GPR35 (0.54) GPR35KDM4EMEN1GRIN2DGRIN3B
SCHEMBL9452197 0.69 GPR35 (0.50) GPR35KDM4EMEN1GRIN2DGRIN3B
SCHEMBL9452283 0.69 HPGD (0.57) GPR35KDM4EMEN1GRIN2DGRIN3B
SCHEMBL9069080 0.69 GPR35 (1.00) GPR35NGFRKDM4EMEN1GRIN2D

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-0062001-A2 Acyl quinolinone derivatives, processes for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1982-10-06 EP claimed
US-4476132-A Acylquinolinone derivatives, and antiallergic preparations and methods of inhibiting allergic reactions using them CIBA-GEIGY CORPORATION (US) 1984-10-09 US disclosed
EP-0062001-A2 Acyl quinolinone derivatives, processes for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1982-10-06 EP disclosed