SCHEMBL5478906

SCHEMBL5478906

C#Cc1cccc2cc3cc4cc5ccccc5cc4cc3cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 2/20 0.40
HSD17B10 Q99714 4/20 0.38
CYP1B1 Q16678 2/20 0.38
HIF1A Q16665 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A1 P04798 1/20 0.36
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HBB P68871 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 4/20 0.35
ERBB2 P04626 1/20 0.35
FYN P06241 1/20 0.35

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
SCHEMBL11126907 1.00 ALDH1A1 (0.40) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL937286 0.98 ALDH1A1 (0.41) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL30918302 0.98 ALDH1A1 (0.41) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL6033716 0.94 ALDH1A1 (0.43) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL28191024 0.94 ALDH1A1 (0.37) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL28776208 0.92 ALDH1A1 (0.45) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL5438141 0.91 CYP1B1 (0.41) ALDH1A1KDM4EGAAHSD17B10CYP1B1
Phenazine SCHEMBL11222513 0.91 NQO2 (0.45) ALDH1A1KDM4EGAAHSD17B10CYP1B1
Biphenyl SCHEMBL22806928 0.90 ALDH1A1 (0.37) ALDH1A1KDM4EGAAHSD17B10CYP1B1
SCHEMBL9928987 0.89 CYP1B1 (0.40) ALDH1A1KDM4EGAAHSD17B10CYP1B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372686-B2 Method for producing an organic thin film transistor and an organic thin film transistor produced by the method KONICA MINOLTA HOLDINGS, INC. (JP) 2013-02-12 US disclosed
US-20070212807-A1 Method for producing an organic thin film transistor and an organic thin film transistor produced by the method EDISON INNOVATIONS LLC 2007-09-13 US disclosed