SCHEMBL13634407

SCHEMBL13634407

CCCNC(=O)c1cc(CN2CCOCC2)ccc1N

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 2/20 0.47
AOC3 Q16853 1/20 0.46
LMNA P02545 4/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
MCHR1 Q99705 1/20 0.44

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
SCHEMBL13634241 0.89 LMNA (0.48) KMT2ALMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL13162599 0.89 KMT2A (0.68) KMT2AKDM4ELMNANPC1RAB9A
SCHEMBL13162383 0.87 KMT2A (0.53) KMT2AKDM4ELMNA
SCHEMBL13634408 0.84 GRM2 (0.43) KMT2AKDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL13634373 0.84 KMT2A (0.57) KMT2ALMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL13634176 0.81 NOS1 (0.50) AOC3LMNANPC1RAB9ASMN1; SMN2
SCHEMBL2774659 0.81 ALDH1A1 (0.59) KMT2AKDM4EAOC3LMNANPC1
SCHEMBL13634358 0.81 CNR2 (0.47) KDM4ELMNAMAPTTSHR
SCHEMBL10272436 0.80 KMT2A (0.77) KMT2AKDM4ELMNANPC1RAB9A
SCHEMBL145235 0.80 PARP1 (0.49) AOC3LMNASMN1; SMN2ALDH1A1MAPT

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