SCHEMBL4879664

SCHEMBL4879664

CCCCC1C2C=CC(C2)C1Cl

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 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
SCHEMBL816628 0.85 CYP1A2 (0.36) CYP1A2
SCHEMBL6237982 0.79 ALDH1A1 (0.38)
SCHEMBL4880035 0.78 CYP1A2 (0.31) CYP1A2
SCHEMBL7543239 0.77 ALDH1A1 (0.41) CYP1A2
SCHEMBL4876972 0.76 ALDH1A1 (0.33) CYP1A2
SCHEMBL11858409 0.73 TSHR (0.48)
SCHEMBL11572262 0.72
SCHEMBL7535053 0.71
SCHEMBL11735435 0.69 GBA1 (0.39)
SCHEMBL13370557 0.68 TSHR (0.36)

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
US-20080125556-A1 Copolymerizing two norbornene monomers, one having a pendant trimethylsilyl or timethylsilylmethyl group, and the other having optional pendant halogen or alkyl groups in the presence of a palladium-based multicomponent catalyst containing palladium, phosphorus, ionic boron and ionic aluminum compounds JSR CORPORATION (JP) 2008-05-29 US disclosed