SCHEMBL4814727

SCHEMBL4814727

Cc1c(F)cccc1[C@H]1[C@@H](C(=O)c2cccc(O)c2)CN([C@@H]2CC3CCN2CC3)C[C@@H]1c1cc[c]cc1O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.33
KDM2B Q8NHM5 2/20 0.31

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
SCHEMBL4751751 0.88 MGLL (0.39) MGLL
SCHEMBL4751750 0.88 MGLL (0.39) MGLL
SCHEMBL4749213 0.87 ALDH1A1 (0.32) MGLLKDM2B
SCHEMBL4749216 0.87 ALDH1A1 (0.32) MGLLKDM2B
SCHEMBL4749439 0.85
SCHEMBL4749442 0.85
SCHEMBL4752161 0.84 KDM2B (0.33) KDM2B
SCHEMBL4751559 0.83 MEN1 (0.32) MGLL
SCHEMBL4752865 0.83
SCHEMBL4749500 0.82

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
WO-2008140810-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-11-20 WO claimed