SCHEMBL14432808

SCHEMBL14432808

COc1ccc(C(SCC(N)CO)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 1.00
DNMT1 P26358 1/20 0.47

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
SCHEMBL14548760 1.00 KIF11 (1.00) KIF11DNMT1
SCHEMBL14537457 1.00 KIF11 (1.00) KIF11DNMT1
SCHEMBL14537459 1.00 KIF11 (1.00) KIF11DNMT1
SCHEMBL14548762 0.89 KIF11 (0.80) KIF11DNMT1
SCHEMBL14548761 0.89 KIF11 (0.80) KIF11DNMT1
SCHEMBL14537509 0.87 KIF11 (0.78) KIF11DNMT1
SCHEMBL14548686 0.87 KIF11 (0.78) KIF11
SCHEMBL15794493 0.87 KIF11 (0.75) KIF11DNMT1
SCHEMBL14537460 0.87 KIF11 (0.75) KIF11DNMT1
SCHEMBL15794494 0.87 KIF11 (0.75) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765817-B1 Selective inhibitors of EG5 motors and methods of use ARROWHEAD CENTER, INC. (US) 2014-07-01 US disclosed
US-8349899-B1 Selective inhibitors of EG5 motors and methods of use ARROWHEAD CENTER, INC. (US) 2013-01-08 US disclosed