SCHEMBL29947864

SCHEMBL29947864

C[C@H](O)CSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.53
DNMT1 P26358 1/20 0.53

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
SCHEMBL10420532 1.00 KIF11 (0.53) KIF11DNMT1
SCHEMBL2303040 0.83 KIF11 (0.51) KIF11DNMT1
SCHEMBL12846954 0.83 KIF11 (0.51) KIF11DNMT1
SCHEMBL24524767 0.80 KIF11 (0.50) KIF11DNMT1
SCHEMBL11544954 0.79 KIF11 (0.60) KIF11DNMT1
SCHEMBL15031000 0.79 KIF11 (0.60) KIF11DNMT1
SCHEMBL18561875 0.79 KIF11 (0.60) KIF11DNMT1
SCHEMBL24337404 0.78 KIF11 (0.51) KIF11DNMT1
SCHEMBL24338381 0.78 KIF11 (0.51) KIF11DNMT1
SCHEMBL5576059 0.78 KIF11 (0.51) KIF11DNMT1

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
EP-4076667-A1 TRICYCLIC PYRIDONES AND PYRIMIDONES Erasca, Inc. (US) 2022-10-26 EP disclosed