SCHEMBL4736783

SCHEMBL4736783

O=C(CSc1ccc(Br)cc1)Nc1cc(Cl)ccc1C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 4/20 0.60
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
ALDH1A1 P00352 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
KDM4E B2RXH2 2/20 0.58
LMNA P02545 3/20 0.54
TP53 P04637 2/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
GAA P10253 1/20 0.50
HTT P42858 1/20 0.50
GRIK2 Q13002 1/20 0.50
KCNK2 O95069 1/20 0.49
KCNK10 P57789 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
TRPM4 Q8TD43 1/20 0.48

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
SCHEMBL4737140 0.90 MEN1 (0.64) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4735039 0.87 L3MBTL1 (0.56) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL4736437 0.82 KMT2A (0.81) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4737108 0.80 POLB (0.59) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4910018 0.79 KMT2A (0.81) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4734522 0.78 ALDH1A1 (0.80) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4734801 0.78 KMT2A (0.57) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL8483939 0.77 KDM4E (0.72) GRIK1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7464454 0.77 L3MBTL1 (0.73) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL7463414 0.76 L3MBTL1 (0.60) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E

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
WO-2008069611-A1 N-PHENYLAMIDE DERIVATIVE, PROCESS FOR THE PREPARATION THEREOF, AND COMPOSITION FOR PREVENTING OR TREATING ISCHEMIC DISEASES COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-06-12 WO claimed
WO-2008069611-A1 N-PHENYLAMIDE DERIVATIVE, PROCESS FOR THE PREPARATION THEREOF, AND COMPOSITION FOR PREVENTING OR TREATING ISCHEMIC DISEASES COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-06-12 WO disclosed