SCHEMBL14938527

SCHEMBL14938527

C/C(=N/NC(=O)Oc1ccccc1)c1ccc(/C=C/c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.54
MAPT P10636 4/20 0.49
POLB P06746 2/20 0.49
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 5/20 0.48
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
RAB9A P51151 3/20 0.46
HDAC1 Q13547 1/20 0.45
MEN1 O00255 4/20 0.45
NPC1 O15118 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
NFKB1 P19838 1/20 0.45
CYP2C19 P33261 1/20 0.45
CASP3 P42574 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45

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
SCHEMBL14938455 0.87 MAPT (0.64) MAPTPOLBALDH1A1KMT2ALMNA
SCHEMBL14938476 0.83 MAPT (0.57) MAPTPOLBALDH1A1KMT2ALMNA
SCHEMBL14938481 0.81 MAPK1 (0.55) MAPTPOLBALDH1A1KMT2ALMNA
SCHEMBL14950318 0.81 RAB9A (0.69) MAPTALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL30616243 0.73 ALDH1A1 (0.50) RAD51MAPTPOLBALDH1A1KMT2A
SCHEMBL12186261 0.73 MAPT (0.70) MAPTPOLBALDH1A1KMT2ALMNA
SCHEMBL14938528 0.72 RAD51 (0.52) RAD51MAPTALDH1A1KMT2ALMNA
SCHEMBL14938458 0.71 ALDH1A1 (0.53) RAD51MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL14938598 0.71 LMNA (0.60) POLBALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL14938448 0.71 RAB9A (0.65) MAPTPOLBALDH1A1KMT2ALMNA

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
WO-2013067646-A1 PROCESS FOR THE SYNTHESIS OF BETA-AMINOCARBONYLS UNIVERSITY OF OTTAWA (CA) 2013-05-16 WO disclosed