SCHEMBL9709023

SCHEMBL9709023

O=C1c2ccccc2[N]c2ccncc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.62
MAOB P27338 1/20 0.62
CDC25B P30305 2/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 3/20 0.39
CYP3A4 P08684 2/20 0.39
KCNQ2 O43526 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 2/20 0.37
GAA P10253 1/20 0.36
MAPT P10636 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TP53 P04637 3/20 0.36
MAPK10 P53779 2/20 0.36
ALDH1A1 P00352 3/20 0.36

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
SCHEMBL9709542 0.89 MAOA (0.62) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL1750489 0.83 MEN1 (0.58) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL421291 0.77 MAOA (1.00) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL29350676 0.77 MAOA (1.00) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL3066734 0.75 MAOA (0.87) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL6926901 0.75 MAOA (0.95) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL496444 0.75 MAOA (0.48) MAOAMAOBCDC25BCYP3A4CYP1A2
SCHEMBL19013209 0.71 MAOA (0.87) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL1386281 0.70 MEN1 (0.46) MAOAMAOBCDC25BMEN1KMT2A
SCHEMBL8417659 0.69 MAOA (0.86) MAOAMAOBCDC25BMEN1KMT2A

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-0471516-A1 Tricyclic heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-19 EP disclosed