SCHEMBL7937655

SCHEMBL7937655

CC(C)(C)c1cc(C2=Cc3ccccc3C2[Hf](Cl)Cl)cc(C(C)(C)C)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
PTAFR P25105 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
SCHEMBL8859962 0.87 PTAFR (0.35) PTAFR
SCHEMBL7928686 0.86 CNR1 (0.33) PTAFR
SCHEMBL6290272 0.81 TACR1 (0.32)
SCHEMBL6285169 0.80 RXRA (0.31) RXRARXRB
SCHEMBL6925960 0.79 RXRA (0.33) RXRARXRBPTAFR
SCHEMBL4089941 0.78 CFTR (0.33)
SCHEMBL28896135 0.77 RXRA (0.31) RXRARXRB
SCHEMBL6287669 0.77 RXRA (0.31) RXRARXRB
Hydrochloric Acid SCHEMBL7937654 0.77 RXRA (0.32) RXRARXRB
SCHEMBL7023536 0.77 RXRA (0.32) RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1157047-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP Corporation North America Inc. (US) 2001-11-28 EP disclosed
WO-2000035975-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. (US) 2000-06-22 WO disclosed