SCHEMBL14373623

SCHEMBL14373623

Oc1ccc(N=Cc2ccc(C=Nc3ccc(O)cc3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.71
S100B P04271 3/20 0.71
ALDH1A1 P00352 7/20 0.70
MAPT P10636 5/20 0.70
KMT2A Q03164 5/20 0.70
MEN1 O00255 4/20 0.70
L3MBTL1 Q9Y468 4/20 0.70
KDM4E B2RXH2 3/20 0.70
BLM P54132 3/20 0.70
ALOX15 P16050 3/20 0.70
HSD17B10 Q99714 3/20 0.70
TP53 P04637 2/20 0.70
MAPK1 P28482 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
LMNA P02545 2/20 0.70
POLB P06746 2/20 0.70
HSP90AA1 P07900 1/20 0.70
HSP90AB1 P08238 1/20 0.70
HPGD P15428 1/20 0.70
CA1 P00915 4/20 0.67

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
SCHEMBL15347676 1.00 CA2 (0.71) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL2839684 1.00 CA2 (0.71) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL11320970 1.00 CA2 (0.71) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL1033699 0.89 CA2 (0.61) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL2891275 0.89 CA2 (0.61) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL10045762 0.89 CA2 (0.61) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL11450591 0.89 CA2 (0.61) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL11458615 0.89 S100B (0.66) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL11458614 0.89 S100B (0.66) CA2S100BALDH1A1MAPTKMT2A
SCHEMBL13780331 0.89 CA2 (0.66) CA2S100BALDH1A1MAPTKMT2A

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-20070298191-A1 Optical Film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-12-27 US disclosed