SCHEMBL14255643

SCHEMBL14255643

CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C\c1ccc2cc[nH]c2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 5/20 0.66
KMT2A Q03164 9/20 0.56
MEN1 O00255 8/20 0.56
MAPT P10636 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
ALDH1A1 P00352 1/20 0.56
MAPK1 P28482 1/20 0.56
HTT P42858 1/20 0.56
MDM2 Q00987 1/20 0.56
GPR55 Q9Y2T6 1/20 0.56
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
POLB P06746 2/20 0.51
NSD2 O96028 1/20 0.51
HSPA1A P0DMV8 1/20 0.51
TNNI3 P19429 1/20 0.51
GRK2 P25098 1/20 0.51
DNMT1 P26358 1/20 0.51
TNNT2 P45379 1/20 0.51
TNNC1 P63316 1/20 0.51

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
SCHEMBL14255659 0.82 KAT8 (0.52) KAT8KMT2AMEN1MAPTALDH1A1
SCHEMBL245319 0.80 KMT2A (0.66) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL245318 0.80 KMT2A (0.66) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL22523764 0.79 KMT2A (0.80) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL420585 0.78 KMT2A (0.72) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL446468 0.76 KAT8 (0.57) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL420541 0.76 KAT8 (0.57) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL446664 0.76 KMT2A (0.66) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL420579 0.76 KMT2A (0.66) KAT8KMT2AMEN1MAPTNPSR1
SCHEMBL446663 0.76 KMT2A (0.66) KAT8KMT2AMEN1MAPTNPSR1

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-1900728-A1 PHARMACEUTICAL COMPOSITION COMPRISING PYRAZOLONE DERIVATIVE Genecare Research Institute Co., Ltd (JP) 2008-03-19 EP disclosed