SCHEMBL13634763

SCHEMBL13634763

CCc1ccc(NC(=O)c2csc(N(C)CCOC)n2)c(C(=O)OC)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.38
POLB P06746 3/20 0.37
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TLR7 Q9NYK1 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HSD17B10 Q99714 2/20 0.37
TRPC3 Q13507 1/20 0.37
TRPC7 Q9HCX4 1/20 0.37
TRPC5 Q9UL62 1/20 0.37
MAPK1 P28482 1/20 0.37
IRAK4 Q9NWZ3 2/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
ALOX12 P18054 1/20 0.36
KDM4E B2RXH2 2/20 0.36
RAB9A P51151 2/20 0.36
KMT2A Q03164 1/20 0.36
PTPN1 P18031 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL13270464 0.93 PTGES (0.37) F10POLBTP53TDP1TLR7
SCHEMBL13634668 0.90 F10 (0.37) F10TP53TLR7HSD17B10TRPC3
SCHEMBL2774000 0.86 POLB (0.49) POLBTP53TDP1SMN1; SMN2HSD17B10
SCHEMBL13163171 0.83 F10 (0.36) F10TP53SMN1; SMN2HSD17B10TRPC3
SCHEMBL13634788 0.82 S1PR1 (0.48) POLBTP53TDP1PTPN1
SCHEMBL13634789 0.82 JAK2 (0.37) F10IRAK4ABCG2
SCHEMBL13163173 0.81 GRM2 (0.37) POLBTP53TDP1SMN1; SMN2MAPK1
SCHEMBL13634600 0.80 IRAK4 (0.42) POLBHSD17B10IRAK4LMNAKDM4E
SCHEMBL15888682 0.80 CRHR1 (0.40) F10SMN1; SMN2HSD17B10TRPC3TRPC7
SCHEMBL13638928 0.79 S1PR1 (0.48) MAPK1

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