SCHEMBL11292003

SCHEMBL11292003

O=C1N(c2ccccc2)C(=O)C12CC2

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.53
MGLL Q99685 1/20 0.48
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.46
EGLN1 Q9GZT9 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
HPGD P15428 1/20 0.42

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
SCHEMBL29331627 0.82 KDM4E (0.42) ELANEMGLLMEN1ALDH1A1KMT2A
SCHEMBL22745971 0.74 ELANE (0.61) ELANEMGLLMEN1ALDH1A1KMT2A
SCHEMBL10948887 0.74 ELANE (0.63) ELANEMGLLALDH1A1GAA
SCHEMBL10409201 0.74 MEN1 (0.54) MEN1KMT2AGAA
SCHEMBL9349507 0.72 ALDH1A1 (0.57) MEN1ALDH1A1KMT2AGAAEGLN1
SCHEMBL22728440 0.70 PGR (0.52) ELANEMEN1ALDH1A1KMT2AGAA
SCHEMBL13879542 0.70 POLB (0.65) ELANEKMT2AGAAEGLN1
SCHEMBL11376669 0.70 ELANE (0.42) ELANEMGLLMEN1ALDH1A1KMT2A
SCHEMBL19105195 0.70 ELANE (0.55) ELANEMGLLMEN1ALDH1A1KMT2A
SCHEMBL16280099 0.69 MGLL (0.62) MGLLMEN1ALDH1A1KMT2AGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57002272-A None JP disclosed
JP-S572272-A PREPARATION OF N-PHENYLCYCLOPROPANEDICARBOXYLIC ACID IMIDE DERIVATIVE SUMITOMO CHEM CO LTD 1982-01-07 JP disclosed