SCHEMBL7685217

SCHEMBL7685217

CN(C)C=C1C(=O)N(c2cc(Cl)cc(Cl)c2)N=C1c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.64
MEN1 O00255 7/20 0.64
ALDH1A1 P00352 5/20 0.64
MAPT P10636 5/20 0.64
KDM4E B2RXH2 5/20 0.64
LMNA P02545 4/20 0.64
TDP1 Q9NUW8 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64
ALOX12 P18054 1/20 0.64
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 2/20 0.46
GAA P10253 2/20 0.46
RECQL P46063 2/20 0.46
GALK1 P51570 1/20 0.46
BLM P54132 1/20 0.46
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
OPRK1 P41145 1/20 0.40

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
SCHEMBL7685215 1.00 KMT2A (0.64) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9727216 0.88 KMT2A (0.75) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9524422 0.88 KMT2A (0.75) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9651820 0.82 KMT2A (0.71) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9651814 0.82 KMT2A (0.71) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9525748 0.79 ALDH1A1 (0.57) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9524411 0.78 KMT2A (0.66) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL10422268 0.78 KMT2A (0.66) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9653587 0.77 KMT2A (0.50) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL15269833 0.77 KMT2A (0.64) KMT2AMEN1ALDH1A1MAPTKDM4E

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