SCHEMBL1440439

SCHEMBL1440439

Cc1cc2[nH]c(=O)n(-c3ccccc3)c2cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
LMNA P02545 3/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
GAA P10253 2/20 0.43
PGR P06401 1/20 0.42
TP53 P04637 1/20 0.42
NTRK1 P04629 1/20 0.41
IGF1R P08069 1/20 0.41

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
SCHEMBL11694281 0.82 MEN1 (0.62) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL18934335 0.81 MEN1 (0.68) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL8886284 0.77 MEN1 (0.77) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL28738835 0.77 MEN1 (1.00) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL17624931 0.77 DAO (0.57) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL31743953 0.77 MEN1 (0.77) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL5718587 0.74 MEN1 (0.68) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL24270831 0.73 MEN1 (0.58) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL30578495 0.73 MEN1 (0.58) MEN1KMT2ALMNAL3MBTL1KDM4E
SCHEMBL4934267 0.72 ATM (0.54) MEN1KMT2ALMNAL3MBTL1KDM4E

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
WO-2011023812-A1 MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 (MPGES1) INHIBITORS NOVASAID AB (SE) 2011-03-03 WO disclosed
WO-2011023812-A1 MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 (MPGES1) INHIBITORS NOVASAID AB (SE) 2011-03-03 WO disclosed