SCHEMBL5070826

SCHEMBL5070826

Cc1c(/C=N\O)c2cc(Br)ccc2n1-c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 7/20 0.48
MAPT P10636 6/20 0.48
HPGD P15428 5/20 0.48
ALDH1A1 P00352 3/20 0.48
POLB P06746 2/20 0.40
KDM4E B2RXH2 5/20 0.38
GAA P10253 3/20 0.38
GFER P55789 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
MAPK1 P28482 3/20 0.37
PKM P14618 2/20 0.37
ALOX15 P16050 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.37
HIF1A Q16665 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL5066641 1.00 HTT (0.48) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5066636 1.00 HTT (0.48) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5069146 0.87 POLB (0.44) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5068231 0.85 MAPT (0.40) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5071761 0.85 MAPT (0.40) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5070804 0.85 POLB (0.40) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5068233 0.85 MAPT (0.40) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5069179 0.85 POLB (0.40) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5069177 0.85 POLB (0.40) HTTMAPTHPGDALDH1A1POLB
SCHEMBL5068725 0.81 TSHR (0.42) HTTMAPTHPGDALDH1A1POLB

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
EP-1653947-B1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVES AS ESTROGENIC AGENTS WYETH CORP (US) 2008-01-16 EP claimed