SCHEMBL7445508

SCHEMBL7445508

NC(=O)CCC(=O)NOc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALPL P05186 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
METAP2 P50579 3/20 0.42
METAP1 P53582 3/20 0.42
MMP1 P03956 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
PARP10 Q53GL7 2/20 0.40
ALDH1A1 P00352 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL10652174 0.83 HDAC1 (0.57) MEN1KMT2AALPLALPIALPG
SCHEMBL3857282 0.81 ALOX5 (0.51) METAP2METAP1CYP3A4CYP2C19L3MBTL1
SCHEMBL8493313 0.80 HDAC2 (0.59) MEN1KMT2AMETAP2METAP1HDAC1
SCHEMBL13771296 0.79 MEN1 (0.51) MEN1KMT2AALPLALPIALPG
SCHEMBL8161055 0.79 HDAC1 (0.53) MEN1KMT2AALPLALPIALPG
SCHEMBL28314990 0.79 ADRA2C (0.53) MEN1KMT2AALPLALPIALPG
SCHEMBL13771653 0.77 HDAC1 (0.51) MEN1KMT2AALPLALPIALPG
SCHEMBL13771004 0.77 HDAC1 (0.51) MEN1KMT2AALPLALPIALPG
SCHEMBL13771003 0.77 HDAC1 (0.51) MEN1KMT2AALPLALPIALPG
SCHEMBL8159623 0.77 HDAC1 (0.69) CYP3A4HDAC1HDAC2KDM4E

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
EP-0706521-A1 NOVEL IMIDES CELGENE CORPORATION (US) 1996-04-17 EP disclosed
WO-1995001348-A2 IMIDES AS INHIBITORS OF TNP ALPHA CELGENE CORPORATION (US) 1995-01-12 WO disclosed