SCHEMBL6911259

SCHEMBL6911259

c1ccc(ON(Oc2ccccc2)[Zr](N(Oc2ccccc2)Oc2ccccc2)(N(Oc2ccccc2)Oc2ccccc2)N(Oc2ccccc2)Oc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.43
TSHR P16473 1/20 0.43
CA4 P22748 1/20 0.39
MAOA P21397 1/20 0.39
KCNA3 P22001 1/20 0.36
CA5A P35218 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
NR1H2 P55055 1/20 0.33
BAX Q07812 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ATM Q13315 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
SRC P12931 1/20 0.32
MEN1 O00255 1/20 0.31

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
SCHEMBL28455421 0.73 LTA4H (0.50) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL10358829 0.69 CA4 (0.48) LTA4HTSHRCA4KCNA3TDP1
SCHEMBL31509748 0.69 LTA4H (0.45) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL2189395 0.69 LTA4H (0.45) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL28667326 0.69 LTA4H (0.45) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL2121427 0.69 LTA4H (0.45) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL1361710 0.67 LTA4H (0.50) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL28216978 0.67 LTA4H (0.43) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL18570099 0.67 LTA4H (0.43) LTA4HTSHRCA4MAOAKCNA3
SCHEMBL9586944 0.65 LTA4H (0.56) LTA4HTSHRCA4MAOAKCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0969010-B1 Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2004-09-22 EP disclosed
US-6352953-B1 TRANSITION METAL COMPLEX HAVING 5-MEMBERED RING FORMED BY TRANSITION METAL COMPOUND OF GROUP IVB, TWO CARBONS, METAL OF GROUP IIIA AND HYDROGEN JAPAN POLYOLEFINS CO., LTD. (JP) 2002-03-05 US disclosed
US-6150544-A Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO., LTD. (JP) 2000-11-21 US disclosed
EP-0969010-A2 Transition metal compound and catalyst containing the same for polymerization of olefins Japan Polyolefins Co., Ltd. (JP) 2000-01-05 EP disclosed