SCHEMBL6906980

SCHEMBL6906980

CC(C)=[Zr](Cl)(Cl)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
SLC22A2 O15244 1/20 0.39
SLC22A3 O75751 1/20 0.39
GPR3 P46089 2/20 0.39
HTR2A P28223 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
KMT2A Q03164 3/20 0.34
ACHE P22303 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
CHRM2 P08172 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 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
SCHEMBL23854485 0.86 POLB (0.35) POLBSLC22A2SLC22A3GPR3
SCHEMBL7611904 0.81 CYP2D6 (0.33) POLBSLC22A2SLC22A3
SCHEMBL6447641 0.80 SLC22A2 (0.31) SLC22A2SLC22A3
SCHEMBL27501188 0.79 POLB (0.31) POLB
SCHEMBL8631527 0.78 POLB (0.30) POLB
SCHEMBL6911936 0.78 SLC22A2 (0.32) POLBSLC22A2SLC22A3
SCHEMBL6903465 0.78
SCHEMBL6445244 0.78
SCHEMBL6447932 0.78 MEN1 (0.36) POLBKMT2AMEN1LMNA
SCHEMBL6904928 0.77 SLC22A2 (0.31) SLC22A2SLC22A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180244812-A1 Spherical Supported Transition Metal Catalyst PETROCHINA COMPANY LIMITED (CN) 2018-08-30 US claimed
US-10808052-B2 Spherical supported transition metal catalyst PETROCHINA COMPANY LIMITED (CN) 2020-10-20 US disclosed
US-20180244812-A1 Spherical Supported Transition Metal Catalyst PETROCHINA COMPANY LIMITED (CN) 2018-08-30 US disclosed
US-6790917-B2 POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-09-14 US disclosed
EP-0872506-B1 Cycloolefin copolymers and uses thereof MITSUI CHEMICALS INC (JP) 2003-08-27 EP disclosed
US-20020198340-A1 Process for producing vinyl compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-26 US disclosed
US-6063886-A MADE FROM AN ALPHA-OLEFIN, CYCLOOLEFIN OF GIVEN FORMULAS, AND VINYL AROMATIC IN GIVEN RELATION; MOLDED ARTICLES SUCH AS FOR OPTICS HAVING HEAT RESISTANCE, TRANSPARENCY, SMALL BIREFRINGENCE MITSUI CHEMICALS (JP) 2000-05-16 US disclosed
EP-0872506-A1 Cycloolefin copolymers and uses thereof Mitsui Chemicals, Inc. (JP) 1998-10-21 EP disclosed