SCHEMBL13634872

SCHEMBL13634872

Cc1ccnc(OC2CCN(c3nc(C(=O)Nc4ccncc4C(=O)O)co3)CC2)n1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR6 P46095 7/20 0.41
ALDH1A1 P00352 1/20 0.39
IRAK4 Q9NWZ3 7/20 0.38
KDM4E B2RXH2 3/20 0.37
PAICS P22234 1/20 0.37
HPGD P15428 1/20 0.36
FGFR1 P11362 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
SCHEMBL13634916 0.93 GPR6 (0.42) GPR6ALDH1A1IRAK4FGFR1
SCHEMBL13634570 0.91 GPR6 (0.40) GPR6ALDH1A1IRAK4KDM4EHPGD
SCHEMBL13634635 0.89 PIM1 (0.45) GPR6ALDH1A1IRAK4
SCHEMBL13634508 0.82 ALDH1A1 (0.41) GPR6ALDH1A1PAICSFGFR1
SCHEMBL13634510 0.81 NAMPT (0.37) GPR6ALDH1A1KDM4EPAICSFGFR1
SCHEMBL13634511 0.81 NAMPT (0.37) GPR6ALDH1A1KDM4EPAICSFGFR1
SCHEMBL13634676 0.81 GPR6 (0.42) GPR6PAICS
SCHEMBL13634835 0.81 PIM1 (0.42) GPR6ALDH1A1PAICS
SCHEMBL13634580 0.80 GPR6 (0.36) GPR6PAICSFGFR1
SCHEMBL13634512 0.80 SCD (0.39) GPR6PAICSFGFR1

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-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed