SCHEMBL6253556

SCHEMBL6253556

CCCCC1=CC(Cc2ccccc2)=CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.37
TLR8 Q9NR97 1/20 0.35
CALM1 P0DP23 1/20 0.34
KCNH2 Q12809 2/20 0.34
LTA4H P09960 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HSD11B1 P28845 1/20 0.33
CETP P11597 1/20 0.33
DNM1 Q05193 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6253565 0.90 CALM1 (0.37) SIGMAR1CALM1LTA4HMEN1KMT2A
SCHEMBL6251692 0.87 SIGMAR1 (0.40) SIGMAR1TLR8KCNH2HSD11B1CETP
SCHEMBL6250272 0.83 TP53 (0.41) SIGMAR1CALM1LTA4H
SCHEMBL1028776 0.81 CALM1 (0.44) SIGMAR1CALM1LTA4HSMN1; SMN2
SCHEMBL1025348 0.79 NPC1 (0.32)
SCHEMBL11022343 0.77
SCHEMBL6253344 0.77 TAAR1 (0.37) SIGMAR1KCNH2MEN1KMT2A
SCHEMBL6255606 0.75 SIGMAR1 (0.42) SIGMAR1CALM1MEN1KMT2A
SCHEMBL6249661 0.73 HSD11B1 (0.37) SIGMAR1HSD11B1
SCHEMBL6253531 0.73 NPC1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0926150-B1 Production of alkali metal cyclopentadienylides and production of dihalobis(eta-substituted-cyclopentadienyl) zirconium from alkali metal cyclopentadienylides HONSHU CHEMICAL IND (JP) 2005-09-07 EP disclosed
US-6046346-A Production of alkali metal cyclopentadienylide and production of dihalobis (η-substituted-cyclopentadienyl) zirconium from alkali metal cyclopentadienylide HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2000-04-04 US disclosed
EP-0926150-A2 Production of alkali metal cyclopentadienylide and production of dihalobis(eta-substituted-cyclopentadienyl) zirconium from alkali metal cyclopentadienylide Honshu Chemical Industry Co. Ltd. (JP) 1999-06-30 EP disclosed