SCHEMBL1933114

SCHEMBL1933114

Oc1cc(O)c2c(-c3ccc(Cl)cc3)c[nH]c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.57
SRC P12931 2/20 0.57
MEN1 O00255 5/20 0.42
MAPT P10636 5/20 0.42
KMT2A Q03164 5/20 0.42
ALOX15 P16050 4/20 0.42
CYP3A4 P08684 4/20 0.42
ALOX12 P18054 3/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP2D6 P10635 2/20 0.42
USP2 O75604 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALOX5 P09917 2/20 0.38
SIRT1 Q96EB6 1/20 0.37
MAPK1 P28482 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL30642997 0.75 PIM1 (0.49) MEN1MAPTKMT2AALOX15CYP3A4
SCHEMBL8574510 0.74 EGFR (0.70) EGFRSRCMEN1MAPTKMT2A
SCHEMBL8574541 0.73 EGFR (1.00) EGFRSRCMEN1MAPTKMT2A
SCHEMBL31140515 0.72 WEE1 (0.49) MEN1MAPTKMT2AALOX15CYP3A4
SCHEMBL6068151 0.69 MEN1 (0.62) MEN1MAPTKMT2AALOX15CYP3A4
SCHEMBL27977953 0.69 DYRK1A (0.50) ALOX5HTR2A
SCHEMBL27856192 0.69 DYRK1A (0.55) ALOX5AURKATPX2GSK3BIDO1
SCHEMBL9812827 0.68 ALOX5 (0.58) MEN1MAPTKMT2AALOX15CYP3A4
Methane SCHEMBL28101908 0.67 MEN1 (0.60) MEN1MAPTKMT2AALOX15CYP3A4
SCHEMBL17982251 0.67 GPR84 (0.55) MEN1MAPTKMT2ACYP3A4CYP1A2

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-2011066606-A1 PYRANOINDOLE COMPOUNDS AND USES THEREOF NOVOGEN RESEARCH PTY LTD (AU) 2011-06-09 WO disclosed