SCHEMBL2653225

SCHEMBL2653225

Cc1cc(-c2ccc(C(F)(F)F)cc2)cc(C)c1OCCCCCCCc1ccc(C(=O)NCCC(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PPARD Q03181 3/20 0.45
PPARA Q07869 1/20 0.45
EPHX2 P34913 1/20 0.44
GCGR P47871 8/20 0.44
GIPR P48546 1/20 0.43
S1PR1 P21453 1/20 0.43
LTB4R Q15722 2/20 0.43
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43

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
SCHEMBL2656779 0.89 PSEN1 (0.53) PPARDPPARAGCGRGIPR
SCHEMBL2652886 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2661613 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2652235 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2654985 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2653662 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2654122 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2653574 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2654583 0.86 MEN1 (0.55) MEN1KMT2AEPHX2GCGRGIPR
SCHEMBL2654850 0.86 GCGR (0.53) MEN1KMT2APPARDPPARAEPHX2

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-1758853-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP disclosed
WO-2005123668-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-29 WO disclosed