SCHEMBL7329417

SCHEMBL7329417

Cc1cc(OCC(=O)Nc2ccncc2)cc(N(C)S(=O)(=O)c2ccccc2Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.53
NOD2 Q9HC29 2/20 0.53
LMNA P02545 5/20 0.48
STAT3 P40763 3/20 0.48
MAPT P10636 1/20 0.48
F2 P00734 2/20 0.48
PRSS2 P07478 1/20 0.48
CTRC Q99895 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
GALR3 O60755 2/20 0.47
MAPK1 P28482 2/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL8545271 0.84 MAPT (0.63) POLBNOD2LMNASTAT3MAPT
SCHEMBL7335280 0.83 F2 (0.60) POLBNOD2LMNASTAT3MAPT
SCHEMBL8542446 0.83 MAPT (0.53) POLBNOD2LMNASTAT3MAPT
SCHEMBL8543251 0.83 MAPT (0.53) POLBNOD2LMNASTAT3MAPT
SCHEMBL7329415 0.81 POLB (0.54) POLBNOD2LMNASTAT3MAPT
SCHEMBL8542584 0.80 KMT2A (0.60) POLBNOD2LMNASTAT3MAPT
SCHEMBL8547111 0.77 KMT2A (0.66) POLBNOD2LMNASTAT3MAPT
SCHEMBL7329809 0.77 F2 (0.70) POLBNOD2LMNASTAT3MAPT
SCHEMBL7327289 0.75 LMNA (0.56) POLBNOD2LMNASTAT3MAPT
SCHEMBL8547707 0.75 LMNA (0.54) POLBNOD2LMNASTAT3MAPT

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