SCHEMBL9727241

SCHEMBL9727241

CC1=NN(c2ccccc2C)C(=O)C1=CNc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.45
KMT2A Q03164 12/20 0.44
MEN1 O00255 9/20 0.44
HSP90AA1 P07900 1/20 0.44
ALDH1A1 P00352 8/20 0.43
MAPT P10636 12/20 0.42
MAPK1 P28482 10/20 0.42
L3MBTL1 Q9Y468 9/20 0.42
TDP1 Q9NUW8 5/20 0.42
HTT P42858 5/20 0.42
LMNA P02545 4/20 0.42
POLB P06746 2/20 0.42
PKM P14618 2/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
OPRK1 P41145 1/20 0.40
RECQL P46063 1/20 0.40
MMP14 P50281 1/20 0.40
KAT8 Q9H7Z6 1/20 0.40

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
SCHEMBL9727237 1.00 KDM4E (0.45) KDM4EKMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL9526497 0.85 ALDH1A1 (0.40) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL9526503 0.85 ALDH1A1 (0.40) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL9524488 0.84 KDM4E (0.62) KDM4EKMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL9524479 0.84 KDM4E (0.62) KDM4EKMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL9524224 0.82 KMT2A (0.60) KDM4EKMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL9524221 0.82 KMT2A (0.60) KDM4EKMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL9525658 0.79 CCKBR (0.38) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL9524485 0.79 ALDH1A1 (0.52) KDM4EKMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL9525542 0.78 KMT2A (0.64) KDM4EKMT2AMEN1ALDH1A1MAPT

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
US-5162528-A Pre- and post-emergence; phytaphthora in tomato plants; rice and wheat BAYER AKTIENGESELLSCHAFT (DE) 1992-11-10 US claimed