SCHEMBL6909006

SCHEMBL6909006

CCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.55

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
SCHEMBL26224 1.00 KIF11 (0.55) KIF11
SCHEMBL18599373 0.98 KIF11 (0.57) KIF11
SCHEMBL10418791 0.87 KIF11 (0.47) KIF11
Trifluoroacetamide SCHEMBL28040960 0.85 KIF11 (0.48) KIF11
SCHEMBL11708407 0.85 KIF11 (0.38) KIF11
SCHEMBL9106215 0.84 KIF11 (0.63) KIF11
SCHEMBL19154882 0.83 SIRT2 (0.50) KIF11
SCHEMBL11295432 0.83 KIF11 (0.37) KIF11
SCHEMBL11705896 0.83 KIF11 (0.37) KIF11
SCHEMBL11615917 0.83 KIF11 (0.37) KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014160638-A1 PROCESS OF MAKING PROSTACYCLIN COMPOUNDS WITH LINKER THIOL AND PEGYLATED FORMS UNITED THERAPEUTICS CORPORATION (US) 2014-10-02 WO disclosed
WO-2011012722-A1 PRODRUGS CONTAINING AN AROMATIC AMINE CONNECTED BY AN AMIDO BOND TO A LINKER ASCENDIS PHARMA AS (DK) 2011-02-03 WO disclosed