SCHEMBL28040608

SCHEMBL28040608

CCc1cc(CC)cc([Si]([C]2C=Cc3ccccc32)(c2cc(CC)cc(CC)c2)c2cc(CC)cc(CC)c2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.34
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SETD7 Q8WTS6 1/20 0.33
TP53 P04637 2/20 0.32
RPS6KA2 Q15349 1/20 0.32
CYP1A2 P05177 3/20 0.31
CYP2D6 P10635 2/20 0.31
ALOX15 P16050 2/20 0.31
HTR1A P08908 2/20 0.31
DRD2 P14416 2/20 0.31
HTR2A P28223 2/20 0.31
SLC6A4 P31645 2/20 0.31
HRH1 P35367 2/20 0.31
RET P07949 1/20 0.31

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
SCHEMBL28040412 0.83 GPR3 (0.41) LMNAALDH1A1L3MBTL1SETD7TP53
SCHEMBL28823624 0.76 LOXL2 (0.39) ALDH1A1SMN1; SMN2CYP3A4HTR6
SCHEMBL27886299 0.75 LMNA (0.39) LMNAMAPTALDH1A1SETD7TP53
SCHEMBL28040419 0.74 ALDH1A1 (0.34) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL28040837 0.74 KDM4E (0.31) LMNAMAPTALDH1A1ALOX15MEN1
SCHEMBL28040843 0.74 MAPT (0.39) LMNAMAPTALDH1A1NPC1MAPK1
SCHEMBL27953350 0.74 HSD11B1 (0.39) LMNAALDH1A1SMN1; SMN2SETD7TP53
SCHEMBL28040770 0.72 PTAFR (0.33) LMNAMAPTALDH1A1NPC1MAPK1
SCHEMBL8079478 0.71 LMNA (0.39) LMNAMAPTALDH1A1SETD7TP53
SCHEMBL8080819 0.70 SETD7 (0.39) LMNAMAPTALDH1A1SETD7TP53

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
CN-102666561-B Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement SUMITOMO CHEMICAL CO.,LTD. (JP) 2015-11-25 CN disclosed