SCHEMBL9346643

SCHEMBL9346643

c1cc2cc(c1)-c1cccc3[nH]c-2nc13

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 9/20 0.54
MGAM O43451 8/20 0.54
SI P14410 8/20 0.54
MGAM2 Q2M2H8 8/20 0.54
DHODH Q02127 3/20 0.49
PARP1 P09874 5/20 0.49
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47
BLM P54132 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CLK2 P49760 2/20 0.45

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
SCHEMBL4457030 0.93 DHODH (0.53) GAAMGAMSIMGAM2DHODH
SCHEMBL230979 0.89 DHODH (0.53) GAAMGAMSIMGAM2DHODH
SCHEMBL31027957 0.85 DHODH (0.59) GAAMGAMSIMGAM2DHODH
SCHEMBL5051916 0.85 MGAM (0.56) GAAMGAMSIMGAM2DHODH
SCHEMBL7146754 0.84 DHODH (0.62) GAAMGAMSIMGAM2DHODH
SCHEMBL1170898 0.83 DHODH (0.54) GAAMGAMSIMGAM2DHODH
SCHEMBL8818524 0.82 MGAM (0.68) GAAMGAMSIMGAM2DHODH
SCHEMBL8817536 0.82 NR1I3 (0.58) GAAMGAMSIMGAM2DHODH
SCHEMBL8816555 0.82 DHODH (0.51) GAAMGAMSIMGAM2DHODH
SCHEMBL8891044 0.82 MGAM (0.68) GAAMGAMSIMGAM2DHODH

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-0397152-B1 Process for making a graphite film MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1994-08-24 EP claimed