SCHEMBL4022303

SCHEMBL4022303

Cc1c(F)cccc1C1[C@@H](C(=O)c2cccc(O)c2)CN(CC(C)(C)O)C[C@@H]1C(=O)c1cccc(O)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 7/20 0.34
MGLL Q99685 6/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC2A1 P11166 1/20 0.32
SLC2A4 P14672 1/20 0.32
KCNH2 Q12809 2/20 0.31
MC4R P32245 1/20 0.31
MC3R P41968 1/20 0.31
KIF11 P52732 1/20 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
SCHEMBL4028130 0.89 KDM2B (0.35) KDM2BMGLLMEN1KMT2ASLC2A1
SCHEMBL4752190 0.89 KDM2B (0.34) KDM2BMGLL
SCHEMBL4028319 0.87 KDM2B (0.43) KDM2BMEN1KMT2A
SCHEMBL4778094 0.87 KDM2B (0.32) KDM2B
SCHEMBL4024173 0.87 KDM2B (0.33) KDM2BMGLLMEN1KMT2A
SCHEMBL4749457 0.86
SCHEMBL4021957 0.86 KDM2B (0.32) KDM2BMGLLMEN1KMT2A
SCHEMBL4024540 0.86 MEN1 (0.35) KDM2BMGLLMEN1KMT2ASLC2A1
SCHEMBL4020633 0.86 MEN1 (0.35) KDM2BMGLLMEN1KMT2ASLC2A1
SCHEMBL13720775 0.86 MEN1 (0.35) KDM2BMGLLMEN1KMT2ASLC2A1

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
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US claimed