SCHEMBL13638113

SCHEMBL13638113

CCOC(=O)c1n[nH]c2c1CC1C2C12CCCC2

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 14/20 0.67
HSD17B1 P14061 1/20 0.41
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.37
PDE4D Q08499 1/20 0.35
KDM5B Q9UGL1 1/20 0.34

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
SCHEMBL13631728 1.00 HCAR2 (0.67) HCAR2HSD17B1KDM4EMEN1MAPT
SCHEMBL13638224 0.99 HCAR2 (0.65) HCAR2HSD17B1KDM4EMEN1MAPT
SCHEMBL13673279 0.99 HCAR2 (0.65) HCAR2HSD17B1KDM4EMEN1MAPT
SCHEMBL13631734 0.99 HCAR2 (0.65) HCAR2HSD17B1KDM4EMEN1MAPT
SCHEMBL13631695 0.96 HCAR2 (0.60) HCAR2HSD17B1KDM4EMEN1MAPT
SCHEMBL13631729 0.80 HCAR2 (1.00) HCAR2
SCHEMBL13638166 0.80 HCAR2 (1.00) HCAR2
SCHEMBL13631736 0.79 HCAR2 (0.97) HCAR2
SCHEMBL13638167 0.79 HCAR2 (0.97) HCAR2
SCHEMBL4479606 0.78 HCAR2 (0.44) HCAR2HSD17B1KDM4EMEN1MAPT

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-7612106-B2 Fused pyrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2009-11-03 US disclosed