SCHEMBL8317334

SCHEMBL8317334

NC(=O)c1ccc2c(c1)CCC(COCc1ccccc1)O2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.51
ITGA2B P08514 2/20 0.51
CA2 P00918 1/20 0.43
LMNA P02545 1/20 0.42
DRD2 P14416 8/20 0.41
DRD4 P21917 8/20 0.41
DRD3 P35462 8/20 0.41
DRD1 P21728 2/20 0.41
DRD5 P21918 2/20 0.41
PARP10 Q53GL7 1/20 0.40
ACHE P22303 1/20 0.39
PTGDR Q13258 1/20 0.39

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
SCHEMBL7636277 0.91 ITGB3 (0.48) ITGB3ITGA2BCA2LMNADRD2
SCHEMBL8322381 0.89 LMNA (0.43) ITGB3ITGA2BLMNADRD1PARP10
SCHEMBL7629751 0.80 LMNA (0.43) ITGB3ITGA2BCA2LMNADRD2
SCHEMBL7631192 0.79 CA2 (0.57) CA2LMNADRD2DRD4DRD3
SCHEMBL6855344 0.78 ITGB3 (0.48) ITGB3ITGA2BLMNADRD2DRD4
SCHEMBL7627971 0.77 RAB9A (0.46) ITGB3ITGA2BDRD2DRD4DRD3
Hydrochloric Acid SCHEMBL6855339 0.77 ITGB3 (0.48) ITGB3ITGA2BLMNADRD2DRD4
SCHEMBL8458648 0.75 ITGB3 (0.40) ITGB3ITGA2BCA2LMNADRD2
SCHEMBL10366696 0.75 TDP1 (0.48) ITGB3ITGA2BDRD2DRD4DRD3
SCHEMBL27280906 0.75 TDP1 (0.48) ITGB3ITGA2BDRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888327-A1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1999-01-07 EP claimed
WO-1997034885-A1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-09-25 WO claimed