SCHEMBL10552256

SCHEMBL10552256

CC(Cl)(Cl)C(O)(O)c1nc2ncncc2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NR3C1 P04150 2/20 0.32
NPY5R Q15761 1/20 0.32
ENPP1 P22413 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31

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
SCHEMBL10550617 0.82 METAP2 (0.37) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL14336558 0.80 METAP2 (0.44) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL2202798 0.80 METAP2 (0.44) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL10694869 0.77 METAP2 (0.39) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL23452695 0.75 METAP2 (0.40) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL3014791 0.74 HSD17B10 (0.57) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL10600444 0.73 METAP2 (0.48) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL23452690 0.73 METAP2 (0.38) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL24859702 0.71 METAP2 (0.37) METAP2METAP1HTTHSD17B10NR3C1
SCHEMBL24859763 0.71 METAP2 (0.37) METAP2METAP1HTTHSD17B10NR3C1

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-4853386-A INHIBITORS OF SRS-A(SLOW REACTING SUBSTANCE OF ANAPHYLAXIS) FROM LUNG TISSUES BOEHRINGER MANNHEIM GMBH (DE) 1989-08-01 US disclosed