SCHEMBL11270397

SCHEMBL11270397

COc1ccc(N2C(=O)CN(C)C2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.61
MGLL Q99685 1/20 0.53
MAPT P10636 4/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RAB9A P51151 1/20 0.51
GAA P10253 3/20 0.50
ELANE P08246 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
RUNX1 Q01196 1/20 0.44
CBFB Q13951 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 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
SCHEMBL5301085 0.82 MGLL (0.54) POLBMGLLMAPTALDH1A1LMNA
SCHEMBL10192188 0.80 ELANE (0.57) POLBMGLLMAPTMEN1KMT2A
SCHEMBL8117138 0.80 POLB (0.67) POLBMGLLMAPTMEN1KMT2A
SCHEMBL10858522 0.79 ELANE (0.47) POLBMGLLMAPTMEN1KMT2A
SCHEMBL852972 0.79 POLB (0.42) POLBMAPTMEN1KMT2ARAB9A
SCHEMBL11276548 0.78 ENPP2 (0.49) MGLLMEN1KMT2ARAB9AGAA
SCHEMBL19410377 0.77 POLB (0.43) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL12444397 0.76 POLB (1.00) POLBMGLLMAPTMEN1KMT2A
SCHEMBL19707557 0.74 MGLL (0.64) POLBMGLLMAPTMEN1KMT2A
SCHEMBL854476 0.73 SIRT6 (0.49) POLBMAPTMEN1KMT2ARAB9A

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-4345936-A Imidazoles, compositions and herbicidal method ELI LILLY AND COMPANY (US) 1982-08-24 US disclosed