SCHEMBL7682165

SCHEMBL7682165

COc1ccc(/C=C2/C(=O)N(c3cc(Cl)cc(Cl)c3)N=C2c2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.64
KMT2A Q03164 7/20 0.64
MAPT P10636 6/20 0.64
ALDH1A1 P00352 4/20 0.64
GAA P10253 4/20 0.64
KDM4E B2RXH2 2/20 0.64
THRB P10828 1/20 0.64
L3MBTL1 Q9Y468 2/20 0.55
POLB P06746 2/20 0.55
RECQL P46063 1/20 0.55
GALK1 P51570 1/20 0.55
BLM P54132 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
GFER P55789 1/20 0.53
HPGD P15428 2/20 0.52
PKM P14618 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49

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
SCHEMBL7682169 1.00 MEN1 (0.64) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL5469970 0.81 MEN1 (0.83) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL5469976 0.81 MEN1 (0.83) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL28967915 0.76 MEN1 (0.71) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL28967912 0.76 MEN1 (0.71) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL7685215 0.76 KMT2A (0.64) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL7685217 0.76 KMT2A (0.64) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL3134918 0.75 KMT2A (0.74) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL3134925 0.75 KMT2A (0.74) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL5462957 0.74 MEN1 (0.53) MEN1KMT2AMAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410533-B1 THERAPY FOR BACTERIA INFECTIONS GENZYME CORPORATION 2002-06-25 US disclosed