SCHEMBL7123418

SCHEMBL7123418

CN=C=Nc1ccc(N(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
TSHR P16473 6/20 0.50
MAPK1 P28482 6/20 0.50
HSD17B10 Q99714 4/20 0.50
TP53 P04637 3/20 0.50
HIF1A Q16665 1/20 0.50
ALOX15 P16050 4/20 0.48
TDP1 Q9NUW8 5/20 0.47
ADRA2A P08913 2/20 0.45
ADRA2B P18089 2/20 0.45
ADRA2C P18825 2/20 0.45
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
NOS1 P29475 2/20 0.44
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL134659 0.89 ALDH1A1 (0.56) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL3275717 0.81 ALDH1A1 (0.67) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL3275767 0.78 ALDH1A1 (0.45) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL249847 0.76 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL163992 0.76 TSHR (0.58) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL11320017 0.76 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL15086596 0.75 ACHE (0.40) ALDH1A1MAPK1TDP1MAPTNOS1
SCHEMBL7054320 0.74 ALDH1A1 (0.61) ALDH1A1TSHRMAPK1HSD17B10TP53
SCHEMBL23465171 0.73 LMNA (0.38) ALDH1A1MAPK1TDP1KMT2AMEN1
SCHEMBL1535350 0.72 MIF (0.50) ALDH1A1TSHRMAPK1HSD17B10TDP1

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-20030194660-A1 Heat developable light sensitive material and image forming method FUJI PHOTO FILM CO., LTD. (JP) 2003-10-16 US disclosed