SCHEMBL3247305

SCHEMBL3247305

CCCCNC(=O)CN1C(=O)CCc2cc(-c3cc(Cl)cc(Cl)c3)cnc21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PABPC1 P11940 1/20 0.41
PPARG P37231 1/20 0.41
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
DDAH1 O94760 1/20 0.36
VDR P11473 1/20 0.36
GCGR P47871 1/20 0.35
CYP11B2 P19099 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 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
SCHEMBL3129449 0.83 KDM4E (0.45) LMNAPOLBMAPTKDM4EMEN1
SCHEMBL3241068 0.81 CYP11B2 (0.41) CYP1A2CYP11B2
SCHEMBL3240923 0.78 MET (0.38) KDM4EALDH1A1CYP11B2
SCHEMBL3122131 0.74 MAPK1 (0.43) MAPTMEN1KMT2AALDH1A1TSHR
SCHEMBL3246493 0.74 FNTA (0.39) LMNAKDM4EMEN1KMT2AALDH1A1
SCHEMBL3246489 0.73 CYP11B2 (0.36) LMNAKDM4EMEN1KMT2AALDH1A1
SCHEMBL13521710 0.71 GRIN1 (0.53) POLB
SCHEMBL3118956 0.71 GRIN1 (0.43) LMNAKDM4EMEN1KMT2APABPC1
SCHEMBL13521717 0.71 GRIN2B (0.49) POLBKDM4EKMT2AALDH1A1
SCHEMBL3122850 0.71 GRIN1 (0.50) POLBKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010008777-A2 FUSED AZABICYCLIC PYRIDINES LIGAND PHARMACEUTICALS INC. (US) 2010-01-21 WO claimed
WO-2010008777-A2 FUSED AZABICYCLIC PYRIDINES LIGAND PHARMACEUTICALS INC. (US) 2010-01-21 WO disclosed
WO-2010008777-A2 FUSED AZABICYCLIC PYRIDINES LIGAND PHARMACEUTICALS INC. (US) 2010-01-21 WO disclosed