SCHEMBL7108452

SCHEMBL7108452

[Hf]C1=CC=CC1.c1ccc(CCc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.43
MAOA P21397 4/20 0.43
KCNH2 Q12809 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TAAR1 Q96RJ0 3/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
CYP2A6 P11509 1/20 0.37
HTR2A P28223 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37

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
Biphenyl SCHEMBL27543063 0.81 ALDH1A1 (0.41) MAOAALDH1A1HSD17B10TAAR1ATM
Phenol SCHEMBL8755117 0.78 CA12 (0.46) ALDH1A1TDP1
Toluene SCHEMBL6284595 0.78 LMNA (0.46) HPGDALOX12
SCHEMBL491037 0.78
Fluoride SCHEMBL1539673 0.75
Hydrochloric Acid SCHEMBL1539667 0.75
Bromide SCHEMBL5406115 0.75
Fluoride SCHEMBL5401001 0.75
Hydrochloric Acid SCHEMBL1590052 0.75
Bromide SCHEMBL1539708 0.75

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-1296991-B1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2013-05-15 EP disclosed
EP-1296991-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION ExxonMobil Chemical Patents Inc. (US) 2003-04-02 EP disclosed
EP-1297027-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Patents Inc. (US) 2003-04-02 EP disclosed
WO-2002000738-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-01-03 WO disclosed
WO-2002000666-A1 SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-01-03 WO disclosed