SCHEMBL7573259

SCHEMBL7573259

C(#Cc1cccc2ccccc12)C/N=C/c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
HTT P42858 2/20 0.43
MITF O75030 1/20 0.43
RAD52 P43351 1/20 0.43
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
CHAT P28329 2/20 0.40
RRM1 P23921 1/20 0.37
DHODH Q02127 1/20 0.35
GRM5 P41594 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
CA2 P00918 2/20 0.33
LMNA P02545 2/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA1 P00915 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL7573263 1.00 MAPT (0.43) MAPTMEN1KMT2AHTTMITF
SCHEMBL7573246 0.89 MEN1 (0.37) MAPTMEN1KMT2AHTTMITF
SCHEMBL7573242 0.89 MEN1 (0.37) MAPTMEN1KMT2AHTTMITF
SCHEMBL7571831 0.86 CHRM5 (0.43) MAPTMEN1KMT2AHTTMITF
SCHEMBL7571835 0.86 CHRM5 (0.43) MAPTMEN1KMT2AHTTMITF
SCHEMBL7580532 0.83 MAPT (0.47) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7573389 0.81 MEN1 (0.49) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7571819 0.80 CYP1A2 (0.39) MAPTMEN1KMT2AHTTMITF
SCHEMBL7571823 0.80 CYP1A2 (0.39) MAPTMEN1KMT2AHTTMITF
SCHEMBL7573298 0.78 CA2 (0.38) L3MBTL1CA2LMNACA1SMN1; SMN2

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-0810199-B1 Method for producing propargylamine compounds SUMITOMO CHEMICAL CO (JP) 2002-09-25 EP disclosed
US-5756769-A Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1998-05-26 US disclosed
EP-0810199-A1 Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-03 EP disclosed