SCHEMBL13634740

SCHEMBL13634740

CCCNC(=O)c1cc(CN2CCOCC2)ccc1NC(=O)c1csc(N2CC(OC)C2)n1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
S1PR1 P21453 1/20 0.40
F10 P00742 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.39
KDM4E B2RXH2 1/20 0.39
DRD4 P21917 1/20 0.39
ACHE P22303 1/20 0.38
OPRK1 P41145 1/20 0.38

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
SCHEMBL13634884 0.95 S1PR1 (0.40) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL2772472 0.94 KMT2A (0.49) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL13270599 0.93 MAPT (0.41) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL13638999 0.93 KMT2A (0.43) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL13634757 0.92 MAPT (0.40) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL13634662 0.91 IRAK4 (0.47) MAPTTSHRKMT2AF10IRAK4
SCHEMBL13634785 0.90 MAPK1 (0.43) MAPTTSHRKMT2AS1PR1F10
SCHEMBL13634889 0.90 ACHE (0.42) MAPTTSHRKMT2AS1PR1F10
SCHEMBL13634851 0.90 PDE4B (0.44) KMT2AF10KDM4E
SCHEMBL13638912 0.89 KMT2A (0.47) MAPTTSHRKMT2AMEN1ALDH1A1

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