SCHEMBL7942918

SCHEMBL7942918

[CH]Oc1ccc(C(CC)=NOC)cc1C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GSK3B P49841 1/20 0.41
NPSR1 Q6W5P4 2/20 0.39
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
TAS1R3 Q7RTX0 3/20 0.35
TAS1R1 Q7RTX1 3/20 0.35
ALDH1A1 P00352 2/20 0.35
PDE4B Q07343 2/20 0.34
DRD4 P21917 2/20 0.34
DRD2 P14416 1/20 0.34
MAPT P10636 2/20 0.34
ALOX15 P16050 1/20 0.34
THRB P10828 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7942916 1.00 GAA (0.45) GAAMEN1KMT2AGSK3BNPSR1
SCHEMBL7942915 0.87 GAA (0.41) GAAMEN1KMT2ANPSR1PPARG
SCHEMBL7942914 0.87 GAA (0.41) GAAMEN1KMT2ANPSR1PPARG
SCHEMBL16202070 0.82 GSK3B (0.46) GAAMEN1KMT2AGSK3BNPSR1
SCHEMBL17215833 0.80 GAA (0.50) GAAMEN1KMT2AGSK3BALDH1A1
SCHEMBL15851022 0.80 GAA (0.50) GAAMEN1KMT2AGSK3BALDH1A1
SCHEMBL7941496 0.80 ALOX15 (0.36) GAAGSK3BPPARGPPARDPPARA
SCHEMBL7941499 0.80 ALOX15 (0.36) GAAGSK3BPPARGPPARDPPARA
SCHEMBL7941466 0.73 PPARG (0.38) PPARGPPARDPPARATAS1R3TAS1R1
SCHEMBL7941464 0.73 PPARG (0.38) PPARGPPARDPPARATAS1R3TAS1R1

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
US-6274586-B1 SYNERGISTIC MIXTURE WITH METHYL (N-METHOXY)-PHENYLCARBAMATE DERIVATIVE BASF AKTIENGESELLSCHAFT (DE) 2001-08-14 US claimed