SCHEMBL13634404

SCHEMBL13634404

CCCNC(=O)c1cc(CN2CCOCC2(C)C)ccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
CYP2C19 P33261 1/20 0.43
SIRT6 Q8N6T7 1/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.39
GRM2 Q14416 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL13634408 0.87 GRM2 (0.43) LMNAKMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL13634373 0.85 KMT2A (0.57) LMNAMEN1KMT2ASMN1; SMN2CYP2C19
SCHEMBL13634356 0.85 MAPT (0.44) LMNAMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13163913 0.84 SIRT6 (0.47) LMNAMEN1KMT2ASIRT6MAPT
SCHEMBL15888568 0.84 LMNA (0.44) LMNAMEN1KMT2ASMN1; SMN2CYP2C19
SCHEMBL13162588 0.79 MAPT (0.45) LMNAMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13634236 0.79 MEN1 (0.61) LMNAMEN1KMT2ASMN1; SMN2CYP2C19
SCHEMBL13270391 0.79 LMNA (0.41) LMNAMEN1KMT2ASMN1; SMN2CYP2C19
SCHEMBL13162600 0.77 KMT2A (0.49) LMNAKMT2AMAPTALDH1A1GRM2
SCHEMBL13162385 0.77 KMT2A (0.48) KMT2AGRM2

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