SCHEMBL4734032

SCHEMBL4734032

COC(=O)c1cc(Br)cc(Br)c1NC(=O)C(Sc1ccc(Br)cc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 5/20 0.46
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTT P42858 1/20 0.46
GAA P10253 1/20 0.43
PKM P14618 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HPGD P15428 1/20 0.41
ADAM17 P78536 1/20 0.41
TSHR P16473 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
SCHEMBL4738274 0.89 MAPT (0.45) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4736772 0.85 MAPT (0.47) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4803910 0.81 ALDH1A1 (0.46) MAPTTDP1ALDH1A1GAAPKM
SCHEMBL3856537 0.81 ALDH1A1 (0.46) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4735942 0.79 HTT (0.52) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4749651 0.79 KDM4E (0.54) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4187378 0.78 KDM4E (0.51) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4187568 0.76 ALDH1A1 (0.47) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4751445 0.74 L3MBTL1 (0.58) MAPTTDP1LMNAALDH1A1NPSR1
SCHEMBL4734500 0.74 L3MBTL1 (0.50) MAPTALDH1A1SMN1; SMN2L3MBTL1HPGD

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