SCHEMBL2663063

SCHEMBL2663063

O=C(O)CCNC(=O)c1ccc(CBr)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.48
LMNA P02545 2/20 0.48
RXFP1 Q9HBX9 2/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ESR1 P03372 1/20 0.46
ALDH1A1 P00352 1/20 0.43
PRNP P04156 1/20 0.43
RECQL P46063 1/20 0.43
POLB P06746 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FOLR1 P15328 1/20 0.43
ITGB3 P05106 2/20 0.40
ITGA2B P08514 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 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
SCHEMBL12313820 0.84 RAB9A (0.56) KMT2AL3MBTL1LMNARXFP1GAA
SCHEMBL2650949 0.80 GAA (0.41) KMT2ALMNARXFP1GAANPSR1
SCHEMBL277890 0.79 KMT2A (0.55) KMT2AL3MBTL1LMNARXFP1GAA
SCHEMBL5630030 0.78 MAPK1 (0.63) KMT2ALMNARXFP1GAANPSR1
SCHEMBL279950 0.78 KMT2A (0.71) KMT2AL3MBTL1LMNARXFP1GAA
SCHEMBL2663028 0.77 NPC1 (0.49) KMT2AL3MBTL1LMNARAB9ANPC1
SCHEMBL14395888 0.75 KMT2A (0.51) KMT2AL3MBTL1LMNARXFP1GAA
SCHEMBL8791196 0.74 HPGD (0.46) KMT2ARXFP1GAANPSR1KDM4E
SCHEMBL12265882 0.74 KMT2A (0.60) KMT2AL3MBTL1LMNARXFP1GAA
SCHEMBL4028375 0.74 DAO (0.54) KMT2ALMNARXFP1ALDH1A1PRNP

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
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed