SCHEMBL8575783

SCHEMBL8575783

CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Zr](C1c2ccccc2-c2ccccc21)=[Si](C)C

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM1A O60341 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA9 Q16790 2/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 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 SCHEMBL339000 0.95 ALDH1A1 (0.32) ALDH1A1MAPTPKMHPGDHSD17B10
SCHEMBL6055431 0.85
Hydrochloric Acid SCHEMBL3206726 0.84
SCHEMBL6435009 0.83 BRD4 (0.30)
Hydrochloric Acid SCHEMBL7938954 0.83
SCHEMBL5614147 0.83 KDM4E (0.38) ALDH1A1MAPTPKMHPGDHSD17B10
SCHEMBL5982706 0.82 CES1 (0.34) ALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL3735008 0.81 ENPP3 (0.30) CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL6903228 0.81 KDM4E (0.37) ALDH1A1MAPTPKMHPGDHSD17B10
Hydrochloric Acid SCHEMBL4593404 0.81 KDM4E (0.37) ALDH1A1MAPTPKMHPGDHSD17B10

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
US-5770664-A Catalyst component for producing polyolefin, catalyst for producing polyolefin comprising the catalyst component, and process for producing polyolefin in the presence of the catalyst JAPAN POLYOLEFINS CO., LTD. (JP) 1998-06-23 US disclosed
EP-0707016-B1 Catalyst component for producing polyolefin, catalyst for producing polyolefin comprising the catalyst component, and process for producing polyolefin in the presence of the catalyst JAPAN POLYOLEFINS CO LTD (JP) 1997-09-24 EP disclosed
EP-0707016-A1 Catalyst component for producing polyolefin, catalyst for producing polyolefin comprising the catalyst component, and process for producing polyolefin in the presence of the catalyst JAPAN POLYOLEFINS CO., LTD. (JP) 1996-04-17 EP disclosed