SCHEMBL14403188

SCHEMBL14403188

CCc1cc(Nc2ccc(CCO)cc2)nc(-c2ccccc2)n1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.78
ABCG2 Q9UNQ0 13/20 0.50
ABCB1 P08183 8/20 0.50
MEN1 O00255 2/20 0.49
NPC1 O15118 2/20 0.49
GBA1 P04062 2/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 1/20 0.49
ABCC1 P33527 2/20 0.46

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
SCHEMBL15658387 0.88 PDE4B (1.00) PDE4B
SCHEMBL392277 0.85 ABCG2 (0.70) PDE4BABCG2ABCB1MEN1NPC1
SCHEMBL14403225 0.77 ABCG2 (0.54) PDE4BABCG2ABCB1MEN1NPC1
SCHEMBL15658115 0.75 PDE4B (0.54) PDE4B
SCHEMBL15948018 0.74 PDE4B (0.77) PDE4BABCG2ABCB1ABCC1
Hydrochloric Acid SCHEMBL16669462 0.74 PDE4B (0.76) PDE4BABCG2ABCB1ABCC1
SCHEMBL18325185 0.72 L3MBTL1 (0.50) PDE4BMEN1KMT2A
SCHEMBL15660397 0.71 PDE4B (1.00) PDE4B
SCHEMBL23586241 0.71 PDE4B (0.56) PDE4BABCG2ABCB1MEN1NPC1
SCHEMBL1063729 0.71 PDE4B (0.71) PDE4BABCG2MEN1KMT2AABCC1

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
WO-2007120702-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AND COMBINATION THERAPY RELATING THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed