SCHEMBL6255387

SCHEMBL6255387

CC(C)(C)[Si]1(c2ccccc2)C(c2ccc(C#N)cc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(C#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.40
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
TSHR P16473 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
CYP11B2 P19099 1/20 0.34
ALDH1A3 P47895 1/20 0.33
ALDH1A1 P00352 2/20 0.33
ATM Q13315 1/20 0.33
AR P10275 1/20 0.33
MMP3 P08254 1/20 0.33
SLC22A12 Q96S37 2/20 0.32
ABCG2 Q9UNQ0 2/20 0.32
ABCB1 P08183 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL6255419 0.86 PDE4B (0.31) ALDH1A1
SCHEMBL6257016 0.86 GABRG2 (0.39) TSHRGABRA1GABRG2GABRB3GABRA5
SCHEMBL6257088 0.81 NPC1 (0.36) MAOBTSHRALDH1A3ALDH1A1
SCHEMBL6252814 0.80 PTGS1 (0.37)
SCHEMBL6254415 0.80 HPGD (0.33) MAOBTSHRALDH1A1
SCHEMBL6258899 0.80 TSHR (0.43) KIF11MAOAMAOBTSHRGABRA1
SCHEMBL6255408 0.78 ESR2 (0.37) MAOATSHRGABRA1GABRG2GABRB3
SCHEMBL6258416 0.78 TSHR (0.45) KIF11MAOAMAOBTSHRGABRA1
SCHEMBL6255415 0.78 NPC1 (0.41) TSHRALDH1A1ABCB1
SCHEMBL6256227 0.78 KIF11 (0.50) KIF11TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1143538-B1 Organic electroluminescent element containing a silacyclopentadiene derivative CHISSO CORP (JP) 2005-09-14 EP disclosed
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