SCHEMBL7120750

SCHEMBL7120750

C[Si]1(C)C(c2ccc(C(F)(F)F)cc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.59
BACE1 P56817 2/20 0.46
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
SCN2A Q99250 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TRPV6 Q9H1D0 1/20 0.38
GLO1 Q04760 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
PTPN5 P54829 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37
DPP4 P27487 1/20 0.36
MAPK13 O15264 1/20 0.36
RAF1 P04049 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 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
SCHEMBL10018830 0.94 KIF11 (0.52) KIF11BACE1ALDH1A1TSHRSCN2A
SCHEMBL6253074 0.85 KIF11 (0.53) KIF11BACE1ALDH1A1TSHRSCN2A
SCHEMBL17678815 0.84 KIF11 (0.41) KIF11TSHR
SCHEMBL6258000 0.83 KIF11 (0.52) KIF11BACE1ALDH1A1TSHRSCN2A
SCHEMBL6259257 0.83 SCN2A (0.43) KIF11ALDH1A1TSHRSCN2APTPN5
SCHEMBL10018832 0.82 ALDH1A1 (0.43) KIF11ALDH1A1PTGS2
SCHEMBL81272 0.82 ALDH1A1 (0.40) ALDH1A1KMT2APTGS2
SCHEMBL6255418 0.82 KIF11 (0.42) KIF11BACE1PTGS1PTGS2PTPN5
SCHEMBL6255883 0.81 KIF11 (0.53) KIF11BACE1ALDH1A1TSHRSCN2A
SCHEMBL7125319 0.81 KIF11 (0.57) KIF11BACE1ALDH1A1TSHRSCN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754691-B1 Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORP (JP) 2003-11-19 EP disclosed
EP-1143538-A1 Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative Chisso Corporation (JP) 2001-10-10 EP disclosed
US-6051319-A Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORPORATION (JP) 2000-04-18 US disclosed
US-5986121-A Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORPORATION (JP) 1999-11-16 US disclosed
EP-0754691-A2 Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORPORATION (JP) 1997-01-22 EP disclosed