SCHEMBL13638902

SCHEMBL13638902

Cc1ccccc1NC(=O)c1csc(-c2ccncc2)n1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 5/20 0.78
HPGD P15428 1/20 0.63
CHEK1 O14757 1/20 0.61
LMNA P02545 4/20 0.60
MAPT P10636 4/20 0.60
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
TDP1 Q9NUW8 2/20 0.58
POLB P06746 1/20 0.57
TLR7 Q9NYK1 2/20 0.56
MAPK1 P28482 2/20 0.56
IDE P14735 1/20 0.54
MAPK10 P53779 1/20 0.54
HDAC1 Q13547 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
NPY1R P25929 1/20 0.53
NPY2R P49146 1/20 0.53

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
SCHEMBL3436898 0.92 IRAK4 (0.78) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL13818336 0.85 MAPT (0.60) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL13638811 0.84 RAB9A (0.63) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL13162020 0.83 IRAK4 (0.59) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL13634538 0.82 CHEK1 (0.59) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL2138509 0.82 CHEK1 (0.59) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL6628193 0.81 TDP1 (0.86) IRAK4HPGDLMNAMAPTMEN1
SCHEMBL2139170 0.79 IRAK4 (0.61) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL10851498 0.78 HPGD (1.00) HPGDLMNAMAPTNPC1RAB9A
SCHEMBL12790094 0.77 IRAK4 (0.77) IRAK4HPGDCHEK1LMNAMAPT

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