SCHEMBL797942

SCHEMBL797942

CCCC[Hf]1(CCCC)C2C(C)=C(c3ccccc32)[Si](C)(C)C2=C(C)C1c1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL796986 0.85 BCHE (0.33) BCHEACHE
SCHEMBL796457 0.78 BCHE (0.36) BCHEACHE
SCHEMBL797794 0.77 BCHE (0.36) BCHEACHE
SCHEMBL7599593 0.77 GPR3 (0.31)
SCHEMBL797047 0.76
SCHEMBL797807 0.71 BCHE (0.36) BCHEACHE
SCHEMBL797677 0.69 HTR1A (0.34) BCHEACHE
SCHEMBL796719 0.69 BCHE (0.36) BCHEACHE
SCHEMBL797837 0.68 DRD2 (0.30)
SCHEMBL7194343 0.65 GPR3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP disclosed
EP-1219657-B1 POLYARYLENE AND METHOD FOR PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2008-03-19 EP disclosed
US-6586554-B1 Polyarylene and method for production thereof JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2003-07-01 US disclosed
EP-1262469-A1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-12-04 EP disclosed
EP-1219657-A1 POLYARYLENE AND METHOD FOR PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-07-03 EP disclosed