SCHEMBL8548927

SCHEMBL8548927

O=C1c2ccc(OCCNO)cc2CCN1CCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 14/20 0.53
ITGA2B P08514 14/20 0.53
MAOA P21397 2/20 0.52
MAOB P27338 2/20 0.52
AOC3 Q16853 1/20 0.51
GRM5 P41594 1/20 0.46
S1PR1 P21453 1/20 0.45

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
SCHEMBL8545644 0.90 ITGB3 (0.51) ITGB3ITGA2BAOC3S1PR1
SCHEMBL8547139 0.85 MAOA (0.53) ITGB3ITGA2BMAOAMAOBAOC3
SCHEMBL8550212 0.84 DRD3 (0.55) GRM5
SCHEMBL8543792 0.83 AOC3 (0.47) ITGB3ITGA2BMAOAMAOBAOC3
Formamide SCHEMBL8543151 0.83 ITGB3 (0.48) ITGB3ITGA2BAOC3
SCHEMBL8549552 0.83 AOC3 (0.54) ITGB3ITGA2BMAOAMAOBAOC3
SCHEMBL8545172 0.83 AOC3 (0.54) ITGB3ITGA2BAOC3GRM5
SCHEMBL8549697 0.83 MAOA (0.48) ITGB3ITGA2BMAOAMAOBAOC3
SCHEMBL8543655 0.82 ITGB3 (0.54) ITGB3ITGA2BMAOAMAOBAOC3
SCHEMBL8543334 0.82 ITGB3 (0.48) ITGB3ITGA2BMAOAMAOBAOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0526402-B1 Heteroaryl substituted hydroxylamine derivatives as lipoxygenase inhibitors CIBA GEIGY AG (CH) 1998-01-21 EP disclosed
US-5350761-A Lipoxygenase inhibitors as antiinflammatory agents and antiallergens CIBA-GEIGY CORPORATION (US) 1994-09-27 US disclosed
US-5334600-A Lipoxygenase inhibitors CIBA-GEIGY CORPORATION (US) 1994-08-02 US disclosed
US-5260316-A Lipoxygenase inhibitor CIBA-GEIGY CORPORATION (US) 1993-11-09 US disclosed
EP-0526402-A1 Heteroaryl substituted hydroxylamine derivatives as lipoxygenase inhibitors CIBA-GEIGY AG (CH) 1993-02-03 EP disclosed