SCHEMBL9409970

SCHEMBL9409970

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

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.47
DNMT1 P26358 1/20 0.45

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
SCHEMBL9409962 1.00 KIF11 (0.47) KIF11DNMT1
SCHEMBL8371918 0.84 KIF11 (0.44) KIF11DNMT1
SCHEMBL8371919 0.84 KIF11 (0.44) KIF11DNMT1
SCHEMBL20185750 0.75 KIF11 (0.45) KIF11DNMT1
SCHEMBL20185753 0.75 KIF11 (0.45) KIF11DNMT1
SCHEMBL5739003 0.74 KIF11 (0.41) KIF11DNMT1
SCHEMBL28551163 0.73 KIF11 (0.55) KIF11DNMT1
SCHEMBL18561875 0.70 KIF11 (0.60) KIF11DNMT1
SCHEMBL15031000 0.70 KIF11 (0.60) KIF11DNMT1
SCHEMBL12944846 0.70 KIF11 (0.56) 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-0618221-A2 Heterocyclic inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 1994-10-05 EP disclosed