SCHEMBL13638923

SCHEMBL13638923

COCCNC(=O)c1cc(C2CCN(C)C2)ccc1NC(=O)c1csc(N2CC[C@H](OC)C2)n1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 3/20 0.35
IRAK4 Q9NWZ3 1/20 0.34
CHEK1 O14757 1/20 0.34
FGFR1 P11362 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
NAPEPLD Q6IQ20 1/20 0.33
SCD O00767 2/20 0.33
SCD5 Q86SK9 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
FASN P49327 1/20 0.33
MAPK1 P28482 1/20 0.33
PIM1 P11309 2/20 0.32
PIM3 Q86V86 2/20 0.32
PIM2 Q9P1W9 2/20 0.32
TLR9 Q9NR96 1/20 0.32
TLR8 Q9NR97 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
OPRK1 P41145 1/20 0.32

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
SCHEMBL13634910 0.94 PIN1 (0.35) PIN1IRAK4CHEK1FGFR1HRH3
SCHEMBL13162734 0.90 PIN1 (0.34) PIN1IRAK4CHEK1HRH3NAPEPLD
SCHEMBL13638837 0.89 SCD (0.40) PIN1NAPEPLDSCDSCD5
SCHEMBL13638952 0.88 CHEK1 (0.37) PIN1CHEK1MAPK1
SCHEMBL2773656 0.88 KDM4E (0.43) KMT2AMEN1
SCHEMBL13639003 0.87 PIN1 (0.37) PIN1CHEK1HRH3NAPEPLDSCD
SCHEMBL2770606 0.86 PIN1 (0.37) PIN1CHEK1HRH3NAPEPLDSCD
SCHEMBL2770504 0.86 PIN1 (0.37) PIN1CHEK1HRH3NAPEPLDSCD
SCHEMBL15888680 0.85 PIN1 (0.36) PIN1CHEK1HRH3NAPEPLDSCD
SCHEMBL13163170 0.85 PIN1 (0.36) PIN1CHEK1HRH3NAPEPLDSCD

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