SCHEMBL5010126

SCHEMBL5010126

C[C](c1cccc(-c2ccccc2)c1-c1ccccc1)c1cccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.50
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BCAT2 O15382 1/20 0.44
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
BCL2L1 Q07817 1/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MYC P01106 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 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
SCHEMBL16180782 0.84 HNF4A (0.56) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL5010723 0.83 HNF4A (0.53) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL5013863 0.82 BCAT2 (0.56) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL16113000 0.81 HNF4A (0.44) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
Methyl Alcohol SCHEMBL27488232 0.80 ALDH1A1 (0.50) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL8778491 0.79 HNF4A (0.60) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL225203 0.79 HNF4A (0.71) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL5008897 0.79 HNF4A (0.46) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
Acetic Acid SCHEMBL31401913 0.78 HNF4A (0.53) HNF4AMEN1KMT2ASMN1; SMN2BCAT2
Methyl Alcohol SCHEMBL27552608 0.78 ALDH1A1 (0.48) HNF4AMEN1KMT2ASMN1; SMN2BCAT2

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-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed