SCHEMBL6907620

SCHEMBL6907620

CC(C)(C)N[Si](C)(C)C1C=C(N2CCCCC2)c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
APAF1 O14727 4/20 0.34
NSD2 O96028 2/20 0.34
TDP2 O95551 1/20 0.34
HKDC1 Q2TB90 1/20 0.34
ALDH1A1 P00352 5/20 0.33
MAPT P10636 4/20 0.33
KDM4E B2RXH2 3/20 0.33
USP2 O75604 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
HPGD P15428 3/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
NPC1 O15118 2/20 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
SCHEMBL6749148 0.99 DRD2 (0.33) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6864763 0.97 TSHR (0.33) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6851446 0.97 TSHR (0.33) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6851450 0.97 TSHR (0.33) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6864767 0.97 TSHR (0.33) TSHRAPAF1NSD2TDP2HKDC1
SCHEMBL5679143 0.97 DRD2 (0.33) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6865428 0.96 CYP1A2 (0.32) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6851818 0.96 CYP1A2 (0.32) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6851816 0.96 DRD2 (0.32) TSHRAPAF1NSD2TDP2HKDC1
Hydrochloric Acid SCHEMBL6865425 0.96 DRD2 (0.32) TSHRAPAF1NSD2TDP2HKDC1

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-0923589-B1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-15 EP disclosed
US-6268444-B1 TITANIUM, ZIRCONIUM OR HAFNIUM COMPOUNDS FOR POLYMERIZATION DOW CHEMICAL COMPANY 2001-07-31 US disclosed
EP-0923589-A1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1999-06-23 EP disclosed
WO-1998006727-A1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1998-02-19 WO disclosed