SCHEMBL9635708

SCHEMBL9635708

O=C(O)COc1cccc(-c2nc3ncccc3[nH]2)c1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.66
FAAH O00519 2/20 0.63
PRMT5 O14744 2/20 0.54
FABP4 P15090 1/20 0.54
HPSE Q9Y251 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL9635808 0.87 AURKA (0.69) AURKAFAAHPRMT5HPSEKDM4E
SCHEMBL9635691 0.86 PRMT5 (0.67) AURKAFAAHPRMT5HPSEMEN1
SCHEMBL9634633 0.85 AURKA (0.63) AURKAFAAHPRMT5HPSE
SCHEMBL9634703 0.82 PDE5A (0.57) FAAHPRMT5
SCHEMBL9636233 0.81 PDE2A (0.61) AURKAFAAHKDM4EMEN1ALDH1A1
SCHEMBL9635915 0.80 AURKA (0.67) AURKAFAAHPRMT5
SCHEMBL9634626 0.80 AURKA (0.67) AURKAFAAHPRMT5HPSE
SCHEMBL9635899 0.79 MEN1 (0.53) FABP4KDM4EMEN1ALDH1A1LMNA
SCHEMBL9635758 0.79 PDE2A (0.73) AURKAFAAHKDM4EMEN1ALDH1A1
SCHEMBL14027835 0.79 KDM4E (0.65) AURKAFAAHPRMT5HPSEKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104881-A 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-04-14 US disclosed
US-4616090-A 2-arylimidazopyridines intermediates MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-07 US disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed