SCHEMBL4658451

SCHEMBL4658451

COC(Cc1cc(Cl)ccc1C(=O)NC(C)(C)C)C(N)Cc1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 9/20 0.42
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
DPP4 P27487 2/20 0.37
MDM2 Q00987 1/20 0.36
F11 P03951 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL4658447 1.00 ANO1 (0.42) ANO1MEN1PKMKMT2APOLB
Hydrochloric Acid SCHEMBL4929069 0.99 ANO1 (0.41) ANO1MEN1PKMKMT2APOLB
SCHEMBL4928293 0.84 CTSS (0.43) ANO1MEN1PKMKMT2AF11
SCHEMBL4928298 0.84 CTSS (0.43) ANO1MEN1PKMKMT2AF11
SCHEMBL4611104 0.79 ANO1 (0.42) ANO1MEN1PKMKMT2APOLB
SCHEMBL4611099 0.79 ANO1 (0.42) ANO1MEN1PKMKMT2APOLB
SCHEMBL268086 0.79 LMNA (0.43) ANO1MEN1KMT2ADPP4
Hydrochloric Acid SCHEMBL4919638 0.78 ANO1 (0.41) ANO1MEN1PKMKMT2APOLB
SCHEMBL4598288 0.78 PARP15 (0.40) ANO1MEN1PKMKMT2ADPP4
SCHEMBL4598495 0.77 ANO1 (0.44) ANO1POLBAPEX1DPP4MDM2

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
EP-1910274-A1 PHENYL COMPOUNDS Eli Lilly and Company (US) 2008-04-16 EP disclosed
WO-2007015807-A1 PHENYL COMPOUNDS ELI LILLY AND COMPANY (US) 2007-02-08 WO disclosed