SCHEMBL4751732

SCHEMBL4751732

O=Cc1cc(OBr)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 13/20 0.67
TRIM24 O15164 2/20 0.47
TRIM33 Q9UPN9 2/20 0.47
TYR P14679 1/20 0.47
CDK1 P06493 1/20 0.46

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
SCHEMBL3889158 0.83 ERN1 (0.71) ERN1TRIM24TRIM33TYRCDK1
SCHEMBL29559365 0.80 ERN1 (1.00) ERN1TRIM24TRIM33TYR
SCHEMBL17618925 0.80 ERN1 (0.67) ERN1TRIM24TRIM33TYRCDK1
SCHEMBL120412 0.80 ERN1 (1.00) ERN1TRIM24TRIM33TYR
SCHEMBL14697028 0.79 ERN1 (0.60) ERN1TRIM24TRIM33TYRCDK1
SCHEMBL31587586 0.79 ERN1 (0.60) ERN1TRIM24TRIM33TYRCDK1
SCHEMBL29673489 0.78 ERN1 (0.96) ERN1TRIM24TRIM33TYR
SCHEMBL1509547 0.78 ERN1 (0.65) ERN1TRIM24TRIM33TYRCDK1
SCHEMBL20339337 0.78 ERN1 (0.96) ERN1TRIM24TRIM33TYR
SCHEMBL3887594 0.77 ERN1 (0.62) ERN1TRIM24TRIM33TYRCDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008144483-A2 AGENTS FOR TREATING DISORDERS INVOLVING MODULATION OF RYANODINE RECEPTORS ARMGO PHARMA, INC. (US) 2008-11-27 WO disclosed