SCHEMBL23809558

SCHEMBL23809558

CCO[SiH](CCC/N=C/c1ccccc1/C=N/CCC[Si](OCC)(OCC)OCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA12 O43570 7/20 0.38
CA2 P00918 5/20 0.38
CA9 Q16790 4/20 0.38
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL21117419 0.89 CA12 (0.46) CA12CA2CA9KDM4E
SCHEMBL29331551 0.83 CA12 (0.41) CA12CA2CA9KDM4E
SCHEMBL23507192 0.80 CA12 (0.35) CA12CA2CA9KDM4E
SCHEMBL31422588 0.80 CA12 (0.64) CA12CA2CA9KDM4E
SCHEMBL23507087 0.79
SCHEMBL21117421 0.77 CA12 (0.44) CA12CA2CA9KDM4E
SCHEMBL12250807 0.76 CA2 (0.41) CA12CA2CA9KDM4E
SCHEMBL1259700 0.76 CA2 (0.41) CA12CA2CA9KDM4E
SCHEMBL1259701 0.76 CA2 (0.41) CA12CA2CA9KDM4E
SCHEMBL18235969 0.75

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-20210284827-A1 CONJUGATED DIENE-BASED POLYMER COMPOSITION AND TIRE ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-16 US disclosed