SCHEMBL11240461

SCHEMBL11240461

CNC(=O)C(C(=NO)n1nnc2ccccc21)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 10/20 0.43
MGAM O43451 9/20 0.43
AMY1A P0DUB6 9/20 0.43
SI P14410 9/20 0.43
MGAM2 Q2M2H8 9/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HTT P42858 1/20 0.43
F2 P00734 2/20 0.43
HPGD P15428 1/20 0.43
SLC9A1 P19634 1/20 0.43
DGAT1 O75907 1/20 0.40
KCNMA1 Q12791 1/20 0.40
ASAH1 Q13510 1/20 0.40
F12 P00748 5/20 0.40
MIF P14174 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL17875212 0.72 ASAH1 (0.59) GAAMGAMAMY1ASIMGAM2
SCHEMBL11235063 0.69 DGAT1 (0.53) GAAMGAMAMY1ASIMGAM2
SCHEMBL11235060 0.69 DGAT1 (0.53) GAAMGAMAMY1ASIMGAM2
SCHEMBL535509 0.69 GAA (0.58) GAAMGAMAMY1ASIMGAM2
SCHEMBL20664729 0.68 ASAH1 (0.56) GAAMGAMAMY1ASIMGAM2
SCHEMBL11235925 0.68
SCHEMBL17994056 0.68 GAA (0.57) GAAMGAMAMY1ASIMGAM2
SCHEMBL11225659 0.68
SCHEMBL11248332 0.67 KMT2A (0.32) KMT2A
SCHEMBL535054 0.67 GAA (0.64) GAAMGAMAMY1ASIMGAM2

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-4359469-A Combating pests with N-sulphenylated oxime-carbamates BAYER AKTIENGESELLSCHAFT (DE) 1982-11-16 US disclosed