SCHEMBL11352149

SCHEMBL11352149

CCCCCCCCC(C)Nc1ccccc1Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 3/20 0.43
HDAC1 Q13547 4/20 0.42
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 2/20 0.41
TSHR P16473 2/20 0.41
ALOX12 P18054 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HIF1A Q16665 1/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC8 Q9BY41 6/20 0.39
HDAC3 O15379 4/20 0.39
HDAC6 Q9UBN7 4/20 0.39
HDAC2 Q92769 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
RECQL P46063 2/20 0.39

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
SCHEMBL11353940 1.00 KCNH3 (0.43) KCNH3HDAC1ALDH1A1MAPK1CYP3A4
SCHEMBL11346566 1.00 KCNH3 (0.43) KCNH3HDAC1ALDH1A1MAPK1CYP3A4
SCHEMBL11351689 1.00 KCNH3 (0.43) KCNH3HDAC1ALDH1A1MAPK1CYP3A4
SCHEMBL11342831 0.98 KCNH3 (0.44) KCNH3HDAC1ALDH1A1MAPK1CYP3A4
SCHEMBL11342721 0.94 KCNH3 (0.45) KCNH3HDAC1ALDH1A1MAPK1CYP3A4
SCHEMBL11526271 0.89 ADH1B (0.44) ALDH1A1MAPK1KMT2AMEN1L3MBTL1
SCHEMBL11527742 0.89 ADH1B (0.44) ALDH1A1MAPK1KMT2AMEN1L3MBTL1
SCHEMBL10597073 0.89 ADH1B (0.44) ALDH1A1MAPK1KMT2AMEN1L3MBTL1
SCHEMBL11350592 0.87 ALDH1A1 (0.45) KCNH3HDAC1ALDH1A1MAPK1CYP3A4
SCHEMBL11524920 0.87 IDO1 (0.43) MAPK1KMT2AL3MBTL1KDM4E

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-4304939-A Preparation of N-phenyl-N-alkylphenylenediamines UOP INC. (US) 1981-12-08 US disclosed