SCHEMBL5008902

SCHEMBL5008902

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.43
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LTB4R2 Q9NPC1 3/20 0.38
BCAT2 O15382 1/20 0.38
SOAT1 P35610 2/20 0.37
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA2 P47869 1/20 0.36

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
SCHEMBL5008897 0.86 HNF4A (0.46) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL5008908 0.85 MEN1 (0.47) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL5008840 0.77 HNF4A (0.44) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL5011002 0.76 PDCD1 (0.43) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL11528232 0.76 HNF4A (0.51) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL5010126 0.76 HNF4A (0.50) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL5010723 0.75 HNF4A (0.53) HNF4APDCD1CD274SMN1; SMN2MEN1
Methyl Alcohol SCHEMBL27552608 0.75 ALDH1A1 (0.48) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL5010156 0.73 CHRNB2 (0.52) HNF4APDCD1CD274SMN1; SMN2MEN1
SCHEMBL16180782 0.73 HNF4A (0.56) HNF4ASMN1; SMN2MEN1KMT2AL3MBTL1

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