SCHEMBL5520282

SCHEMBL5520282

Fc1ccc2c(c1)SC=CN2

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.42
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL8030997 0.76 MAOA (0.41)
SCHEMBL226035 0.70 GAA (0.41) NOX1CYP1A2MAPT
SCHEMBL8272552 0.63 NOX1 (0.44) NOX1CYP1A2MAPTCYP2C19
SCHEMBL19244786 0.60
SCHEMBL31552720 0.60 KMT2A (0.55) NOX1CYP1A2MAPTCYP2C19
SCHEMBL8491661 0.59 NOX1 (0.49) NOX1CYP1A2MAPTCYP2C19
SCHEMBL4707754 0.59 NOX1 (0.68) NOX1CYP1A2MAPTCYP2C19
SCHEMBL9511403 0.58 NOX1 (0.48) NOX1CYP1A2
SCHEMBL9508923 0.58 NOX1 (0.48) NOX1CYP1A2
SCHEMBL29411773 0.58 NOX1 (0.48) NOX1CYP1A2

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-1799676-A2 NEW BICYCLIC ANTIBIOTICS Actelion Pharmaceuticals Ltd. (CH) 2007-06-27 EP disclosed
WO-2006032466-A2 NEW BICYCLIC ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2006-03-30 WO disclosed