SCHEMBL2237848

SCHEMBL2237848

C[SiH](C)[Zr](C1(C)C=CC(Cc2ccccc2)=C1)C1(C)C=CC(Cc2ccccc2)=C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.33
KDM4E B2RXH2 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
Hydrochloric Acid SCHEMBL2231586 0.98 KDM4E (0.34) CALM1KDM4ECYP3A4MAPTATM
SCHEMBL2232721 0.66
SCHEMBL12506450 0.66 CALM1 (0.41) CALM1TAAR1MAOAMAOB
SCHEMBL332242 0.63 MAOA (0.31) CALM1MAOAMAOB
SCHEMBL2234615 0.62
SCHEMBL825206 0.62 CALM1 (0.37) CALM1MAOAMAOB
SCHEMBL31206577 0.60 CALM1 (0.34) CALM1MAOAMAOB
Hydrochloric Acid SCHEMBL16459482 0.59 CALM1 (0.33) CALM1MAOAMAOB
SCHEMBL5160999 0.57 CALM1 (0.38) CALM1MAOAMAOB
SCHEMBL1478171 0.57 CALM1 (0.55) CALM1KDM4ECYP3A4MAPTMAOA

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
EP-1799726-B1 TRIALKYLALUMINUM TREATED SUPPORTS EXXONMOBIL CHEM PATENTS INC (US) 2011-07-13 EP claimed