SCHEMBL28048707

SCHEMBL28048707

O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccc2[nH]c3ccc(C(=O)Oc4ccc([N+](=O)[O-])cc4)cc3c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
PKM P14618 1/20 0.59
PDGFRB P09619 1/20 0.55
PDGFRA P16234 1/20 0.55
HGFAC Q04756 1/20 0.53
MAPT P10636 7/20 0.52
GAA P10253 3/20 0.52
HPGD P15428 1/20 0.52
NR1H4 Q96RI1 1/20 0.50
ALOX5 P09917 1/20 0.50
ALDH1A1 P00352 4/20 0.48
THRB P10828 1/20 0.48
CTSV O60911 1/20 0.48
CTSL P07711 1/20 0.48
BCL9 O00512 1/20 0.47
CTNNB1 P35222 1/20 0.47
XDH P47989 1/20 0.46
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 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
SCHEMBL542043 0.82 KMT2A (0.84) KMT2APKMHGFACMAPTGAA
SCHEMBL10636579 0.82 KMT2A (0.84) KMT2APKMHGFACMAPTGAA
SCHEMBL4951809 0.82 KMT2A (0.84) KMT2APKMHGFACMAPTGAA
SCHEMBL18434657 0.82 KMT2A (0.84) KMT2APKMHGFACMAPTGAA
SCHEMBL28048752 0.80 F2 (0.50) KMT2APKMMAPTHPGDNR1H4
SCHEMBL13292702 0.79 MAPT (0.67) KMT2APKMHGFACMAPTGAA
SCHEMBL7185854 0.78 KMT2A (0.64) KMT2APKMHGFACMAPTGAA
SCHEMBL12489991 0.77 PKM (0.77) KMT2APKMPDGFRBPDGFRAHGFAC
SCHEMBL16375430 0.77 KMT2A (0.77) KMT2APKMHGFACMAPTGAA
SCHEMBL3145157 0.77 KMT2A (0.77) KMT2APKMHGFACMAPTGAA

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-105237462-B It is a kind of that there is high flatness diamine monomer and its synthetic method and application containing carbazole structure 湖南工业大学 2018-11-27 CN disclosed
CN-105237462-A Diamine monomer containing carbazole structure and having high planarity, synthetic method and application thereof UNIV HUNAN TECHNOLOGY 2016-01-13 CN disclosed