SCHEMBL7337435

SCHEMBL7337435

CCc1cc(OCC(=O)Nc2ccncc2)cc(OS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.57
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
STAT3 P40763 3/20 0.52
GALR3 O60755 2/20 0.52
POLB P06746 3/20 0.51
NOD2 Q9HC29 2/20 0.51
MAPT P10636 1/20 0.51
KDM4E B2RXH2 1/20 0.51
PKM P14618 1/20 0.51
F2 P00734 1/20 0.49
HSP90AA1 P07900 1/20 0.49
NAMPT P43490 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL7334269 0.90 LMNA (0.59) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL7336072 0.88 LMNA (0.59) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL7334463 0.86 LMNA (0.67) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL8547319 0.81 F2 (0.62) F2
SCHEMBL7333897 0.81 F2 (0.59) LMNAF2SMN1; SMN2ALOX15MAPK1
SCHEMBL7327289 0.78 LMNA (0.56) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL7335280 0.76 F2 (0.60) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL8547707 0.76 LMNA (0.54) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL7337176 0.75 MEN1 (0.56) LMNAKMT2AMEN1STAT3GALR3
SCHEMBL7329684 0.75 F2 (0.69) LMNAKMT2AMEN1STAT3GALR3

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
EP-0687253-B1 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1998-12-16 EP disclosed
EP-0687253-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME Roche Diagnostics GmbH (DE) 1995-12-20 EP disclosed
WO-1994020467-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1994-09-15 WO disclosed