SCHEMBL7599154

SCHEMBL7599154

CC1=C2c3c(C(C)C)cc(C(C)C)cc3C1[Hf](C)(C)C1C(C)=C(c3c(C(C)C)cc(C(C)C)cc31)[Si]2(c1ccccc1)c1ccccc1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 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
SCHEMBL796819 0.84
SCHEMBL7599147 0.82
SCHEMBL7601474 0.81 GABRA1 (0.35) GABRA1GABRB2
SCHEMBL797712 0.76 CASR (0.31)
SCHEMBL7602956 0.76
SCHEMBL797790 0.74
SCHEMBL7602584 0.72
SCHEMBL7602681 0.72
Hydrochloric Acid SCHEMBL4062417 0.72
SCHEMBL5355401 0.72

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-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US disclosed