SCHEMBL10476622

SCHEMBL10476622

COC[C@@H]1CCC(NC(=O)c2cc3cc(Cl)ccc3[nH]2)C(NC(=O)OC(C)(C)C)C1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.50
EHMT2 Q96KQ7 1/20 0.50
SMYD3 Q9H7B4 2/20 0.46
PYGL P06737 3/20 0.46

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
SCHEMBL4275693 1.00 F10 (0.50) F10EHMT2SMYD3PYGL
SCHEMBL3340284 1.00 F10 (0.50) F10EHMT2SMYD3PYGL
SCHEMBL4094101 1.00 F10 (0.50) F10EHMT2SMYD3PYGL
SCHEMBL3340287 1.00 F10 (0.50) F10EHMT2SMYD3PYGL
SCHEMBL3342555 0.91 F10 (0.59) F10EHMT2SMYD3PYGL
SCHEMBL4093951 0.91 F10 (0.59) F10EHMT2SMYD3PYGL
SCHEMBL4087798 0.91 F10 (0.59) F10EHMT2SMYD3PYGL
SCHEMBL15016361 0.91 F10 (0.59) F10EHMT2SMYD3PYGL
SCHEMBL4269437 0.91 F10 (0.59) F10EHMT2SMYD3PYGL
SCHEMBL3342559 0.91 F10 (0.59) F10EHMT2SMYD3PYGL

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-1270557-B1 ETHYLENEDIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-07-25 EP disclosed