SCHEMBL28041355

SCHEMBL28041355

CC(C)(C)c1cc(-c2cccc3c2C=C[CH]3)cc(C(C)(C)C)c1.Cl[Hf]Cl

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
PTAFR P25105 1/20 0.30
KIF11 P52732 1/20 0.30
CNR1 P21554 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
SCHEMBL730698 0.94 RXRA (0.36) RXRARXRBPTAFRKIF11CNR1
SCHEMBL28425655 0.91 RXRA (0.33) RXRARXRBPTAFRKIF11CNR1
SCHEMBL28041346 0.90 KIF11 (0.39) RXRARXRBPTAFRKIF11
SCHEMBL28031396 0.84 KIF11 (0.42) RXRARXRBPTAFRKIF11CNR1
SCHEMBL28041148 0.81
SCHEMBL6012037 0.80 TSHR (0.36) PTAFRKIF11
SCHEMBL3990659 0.79 HTR1A (0.37) RXRARXRBPTAFRCNR1
SCHEMBL27462619 0.77 CYP2A6 (0.36)
SCHEMBL28190399 0.76 RXRA (0.33) RXRARXRBPTAFR
SCHEMBL6650773 0.73 ACHE (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105026408-A Metallocene compound, catalyst for olefin polymer, method for producing olefin polymer, and olefin polymer JAPAN POLYETHYLENE CORP 2015-11-04 CN disclosed