SCHEMBL27925939

SCHEMBL27925939

Cc1ccc(NC(=O)Cc2ccccc2Br)nc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ RAB9A P51151 5/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ MAPT P10636 1/20 0.53
▸ KDM4E B2RXH2 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ GLA P06280 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ HTT P42858 1/20 0.47

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
SCHEMBL31351918 0.86 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL27925932 0.83 WNT3A (0.59) KMT2AMEN1
SCHEMBL27907982 0.80 GAA (0.63) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL22607250 0.80 KMT2A (0.84) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL27925926 0.80 RAB9A (0.62) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL16887483 0.77 KMT2A (0.68) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL839206 0.76 RAB9A (0.66) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL5233630 0.75 HCAR3 (0.56) KMT2AMEN1NPC1ALDH1A1HSD17B10
SCHEMBL1723416 0.75 RAB9A (0.68) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL838607 0.75 RAB9A (0.68) KMT2AMEN1RAB9ANPC1SMN1; SMN2

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
CN-103172636-A Pyridine-quinazolinone compound and preparation method thereof UNIV SHANGHAI 2013-06-26 — — CN disclosed
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