SCHEMBL6908994

SCHEMBL6908994

[Li]C1C(C)=C(N(C)C)c2cc3c(cc21)C(C)(C)CCC3(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.35
RXRG P48443 4/20 0.35
RXRB P28702 3/20 0.35
RARB P10826 3/20 0.32
RARG P13631 3/20 0.32
RARA P10276 4/20 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
SCHEMBL31294415 0.78 RARA (0.36) RXRARXRGRXRBRARBRARG
SCHEMBL21244356 0.68 RXRA (0.33) RXRARXRGRXRBRARBRARG
SCHEMBL6910159 0.68 RXRA (0.33) RXRARXRGRXRBRARBRARG
SCHEMBL4409933 0.65 RXRA (0.36) RXRARXRGRXRBRARBRARG
Hydrochloric Acid SCHEMBL4219941 0.63 RARA (0.33) RXRARXRGRXRBRARBRARG
Hydrochloric Acid SCHEMBL19459980 0.63 RXRA (0.34) RXRARXRGRXRBRARBRARG
SCHEMBL28487057 0.61 RXRA (0.33) RXRARXRGRXRBRARBRARG
SCHEMBL11599145 0.60 RXRA (0.42) RXRARXRGRXRBRARBRARG
SCHEMBL5865567 0.60 RXRA (0.49) RXRARXRGRXRBRARBRARG
SCHEMBL31265037 0.60 RXRA (0.32) RXRARXRGRXRBRARBRARG

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