SCHEMBL7337176

SCHEMBL7337176

COc1ccccc1S(=O)(=O)Oc1cc(C)cc(OCC(=O)Nc2ccncc2)c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
F2 P00734 5/20 0.53
POLB P06746 3/20 0.52
KDM4E B2RXH2 1/20 0.52
GAA P10253 1/20 0.52
LMNA P02545 3/20 0.51
NOD2 Q9HC29 2/20 0.51
STAT3 P40763 2/20 0.51
MAPT P10636 1/20 0.51
GALR3 O60755 2/20 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
SCHEMBL7327289 0.89 LMNA (0.56) MEN1KMT2AF2POLBKDM4E
SCHEMBL7335280 0.87 F2 (0.60) MEN1KMT2AF2POLBKDM4E
SCHEMBL7334269 0.85 LMNA (0.59) MEN1KMT2APOLBKDM4EGAA
SCHEMBL7332258 0.84 F2 (0.71) MEN1KMT2AF2POLBKDM4E
SCHEMBL8548593 0.82 F2 (0.72) F2
SCHEMBL7329684 0.80 F2 (0.69) MEN1KMT2AF2POLBKDM4E
SCHEMBL8547707 0.79 LMNA (0.54) MEN1KMT2AF2POLBLMNA
SCHEMBL7327021 0.78 POLB (0.56) MEN1KMT2AF2POLBKDM4E
SCHEMBL8547104 0.78 KMT2A (0.60) MEN1KMT2APOLBKDM4EGAA
SCHEMBL7326753 0.77 POLB (0.54) MEN1KMT2AF2POLBKDM4E

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