SCHEMBL391607

SCHEMBL391607

Cc1cc(Nc2ccc(CC(O)C(N)c3cc(C)nc(-c4cccc(Cl)c4)n3)cc2)nc(-c2ccccc2)n1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 13/20 0.56
ABCB1 P08183 6/20 0.56
ABCC1 P33527 6/20 0.56
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
NPC1 O15118 2/20 0.49
GBA1 P04062 2/20 0.49
RAB9A P51151 1/20 0.49
PDE4B Q07343 2/20 0.48
PDE4D Q08499 1/20 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
SCHEMBL391608 0.81 ABCG2 (0.57) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL21980348 0.78 ABCG2 (0.85) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL392277 0.71 ABCG2 (0.70) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL21977560 0.69 ABCG2 (1.00) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL14987901 0.67 ABCG2 (0.76) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL16392215 0.66 ABCG2 (0.61) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL390297 0.66 ABCG2 (0.62) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL21979438 0.65 ABCG2 (0.82) ABCG2ABCB1ABCC1MEN1KMT2A
SCHEMBL15658387 0.65 PDE4B (1.00) PDE4BPDE4D
SCHEMBL15660397 0.65 PDE4B (1.00) PDE4BPDE4D

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
US-8101626-B2 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed