SCHEMBL8539648

SCHEMBL8539648

CNC(=O)CC1SC=CC1=NOCC1ON=C1Cc1ccc(C2CCc3ccccc32)cc1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.30

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
SCHEMBL8821308 0.96 HAO1 (0.36) HAO1
SCHEMBL8539630 0.68 HAO1 (0.34) HAO1
SCHEMBL8539119 0.64 HAO1 (0.40) HAO1
SCHEMBL8537723 0.63 HAO1 (0.38) HAO1
Bicarbonate SCHEMBL376797 0.58 SIGMAR1 (0.55) HAO1
SCHEMBL19985007 0.58 PRMT5 (0.51)
SCHEMBL7459424 0.58 HAO1 (0.53) HAO1
SCHEMBL8536147 0.56 HAO1 (0.47) HAO1
Butanedione SCHEMBL17273471 0.55 SIGMAR1 (0.55) HAO1
SCHEMBL8528118 0.55 HIF1A (0.46) HAO1

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-0877730-A1 ARYL ACRYLICS FOR USE AS FUNGICIDE MONSANTO COMPANY (US) 1998-11-18 EP disclosed
WO-1997016413-A1 ARYL ACRYLICS FOR USE AS FUNGICIDE MONSANTO COMPANY (US) 1997-05-09 WO disclosed