SCHEMBL8548599

SCHEMBL8548599

Cc1ccc(S(=O)(=O)Nc2cccc(OCC(=O)Nc3ccncc3)c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.68
KDM4E B2RXH2 5/20 0.63
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
LMNA P02545 3/20 0.61
MAPT P10636 2/20 0.61
ALDH1A1 P00352 2/20 0.59
GALR3 O60755 2/20 0.58
POLB P06746 2/20 0.57
GAA P10253 1/20 0.57
PKM P14618 2/20 0.56
NAMPT P43490 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
HSP90AA1 P07900 1/20 0.55

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
SCHEMBL7330380 0.91 F2 (0.69) F2KDM4EKMT2AMEN1LMNA
SCHEMBL7327269 0.90 F2 (0.66) F2KDM4EKMT2AMEN1LMNA
SCHEMBL8543743 0.90 F2 (0.68) F2KDM4EKMT2AMEN1LMNA
SCHEMBL7359983 0.88 ROCK2 (0.62) F2KDM4EKMT2AMEN1LMNA
SCHEMBL8544004 0.88 F2 (0.70) F2KDM4EKMT2AMEN1LMNA
SCHEMBL8542772 0.83 F2 (0.68) F2KDM4EKMT2AMEN1LMNA
SCHEMBL7335988 0.82 MAPT (0.63) F2KDM4EKMT2AMEN1LMNA
SCHEMBL7324870 0.82 F2 (0.59) F2LMNAMAPTALDH1A1PKM
SCHEMBL7357930 0.82 KMT2A (0.55) F2KMT2AMEN1LMNAMAPT
SCHEMBL7336884 0.82 GALR3 (0.64) KMT2AMEN1LMNAMAPTGALR3

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-0687253-B1 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1998-12-16 EP disclosed