SCHEMBL13899355

SCHEMBL13899355

Cc1nn(-c2ccccc2)nc1CCOc1cccc(C=O)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.47
PPARA Q07869 7/20 0.47
MAOA P21397 4/20 0.46
MAOB P27338 4/20 0.46
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 2/20 0.39
CYP3A4 P08684 2/20 0.39
PKM P14618 1/20 0.39
MPO P05164 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL13899499 0.94 MAOA (0.45) PPARGPPARAMAOAMAOBKDM4E
SCHEMBL13899336 0.88 MAOA (0.54) MAOAMAOBKDM4ENPC1RAB9A
SCHEMBL13899500 0.87 PPARG (0.48) PPARGPPARAKDM4ELMNACYP3A4
SCHEMBL13899537 0.81 LMNA (0.43) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL13899497 0.77 PPARG (0.49) PPARGPPARAMAOAMAOBKDM4E
SCHEMBL13906089 0.76 PPARG (0.43) PPARGPPARAKDM4ELMNACYP3A4
SCHEMBL6310996 0.75 PPARG (0.50) PPARGPPARAKDM4ELMNAPKM
SCHEMBL13899485 0.75 KDM4E (0.47) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL923674 0.73 MAOA (0.71) MAOAMAOBKDM4ENPC1RAB9A
SCHEMBL30791325 0.73 MAOA (0.71) MAOAMAOBKDM4ENPC1RAB9A

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
US-7507757-B2 Substituted heterocyclic derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-24 US disclosed
US-7507757-B2 Substituted heterocyclic derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-24 US disclosed