SCHEMBL11166383

SCHEMBL11166383

c1ccc(C2=NN(c3ccccc3)CC2c2ccco2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.53
MEN1 O00255 9/20 0.50
KMT2A Q03164 9/20 0.50
L3MBTL1 Q9Y468 8/20 0.50
ATM Q13315 5/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MAPT P10636 10/20 0.42
KDM4E B2RXH2 9/20 0.42
ALDH1A1 P00352 8/20 0.42
TDP1 Q9NUW8 7/20 0.42
MAPK1 P28482 7/20 0.42
GLA P06280 6/20 0.42
GAA P10253 5/20 0.42
HPGD P15428 5/20 0.42
LMNA P02545 3/20 0.42
POLB P06746 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HTT P42858 2/20 0.42
PSMD14 O00487 1/20 0.42
MAOA P21397 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
SCHEMBL2864527 0.79 KDM1A (0.53) KDM1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL11050112 0.72 ALDH1A1 (0.46) KDM1AMEN1KMT2AL3MBTL1ATM
SCHEMBL9473152 0.70 EGFR (0.51) KDM1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL11124065 0.67 KDM1A (0.46) KDM1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL22331106 0.67 L3MBTL1 (0.42) KDM1AMEN1KMT2AL3MBTL1ATM
SCHEMBL10939318 0.67 L3MBTL1 (1.00) MEN1KMT2AL3MBTL1ATMRXFP1
SCHEMBL27594191 0.65 ERBB2 (0.38) KDM1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL14279550 0.64 L3MBTL1 (0.54) MEN1KMT2AL3MBTL1ATMRXFP1
SCHEMBL11153238 0.64 L3MBTL1 (0.40) KDM1AMEN1KMT2AL3MBTL1ATM
SCHEMBL28865973 0.62 MAPT (0.47) MEN1KMT2AL3MBTL1ATMRXFP1

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-4387149-A CATIONIC DYES; STABILITY; COPYING MITSUBISHI PAPER MILLS, LTD. (JP) 1983-06-07 US disclosed