SCHEMBL27805290

SCHEMBL27805290

CCCC(=O)Oc1ccc2c(c1)CC(=O)N2

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.49
GAA P10253 6/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
AHR P35869 1/20 0.45
EIF2AK2 P19525 1/20 0.44
BCL9 O00512 1/20 0.43
CTNNB1 P35222 1/20 0.43
EPHX2 P34913 1/20 0.43
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
CA2 P00918 2/20 0.42
GRIA1 P42261 1/20 0.42
CACNG8 Q8WXS5 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
SMYD3 Q9H7B4 2/20 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
SCHEMBL11515388 0.90 MAOB (0.50) MAOBGAAKDM4EALDH1A1KMT2A
SCHEMBL28346887 0.82 GAA (0.52) MAOBGAAALDH1A1KMT2AAHR
SCHEMBL21604 0.82 GAA (0.46) MAOBGAAAHREIF2AK2EPHX2
SCHEMBL6981292 0.81 AHR (0.51) MAOBGAAAHREIF2AK2EPHX2
SCHEMBL6980695 0.80 GAA (0.48) MAOBGAAAHREIF2AK2GRIA1
SCHEMBL27691373 0.80 MAOB (0.50) MAOBGAAKMT2AAHREIF2AK2
SCHEMBL10375833 0.78 MAOB (0.65) MAOBAHREIF2AK2PDE3BPDE3A
SCHEMBL10828352 0.78 AHR (0.51) MAOBGAAAHREIF2AK2EPHX2
SCHEMBL689457 0.78 MAOB (0.62) MAOBGAAKMT2AAHREIF2AK2
SCHEMBL14815914 0.77 MAOB (0.52) MAOBGAAKDM4EALDH1A1GLA

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
CN-101987848-B New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing the same SERVIER LAB 2014-06-18 CN disclosed
CN-101987848-A New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB 2011-03-23 CN disclosed