SCHEMBL4744528

SCHEMBL4744528

Cc1cc(Cl)c2c(Cl)c(Cl)ccc2n1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 2/20 0.39
CYP1A2 P05177 2/20 0.38
MEN1 O00255 1/20 0.38
APEX1 P27695 1/20 0.38
KMT2A Q03164 1/20 0.38
NR4A2 P43354 2/20 0.37
NCF1 P14598 1/20 0.36
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PARP1 P09874 1/20 0.35
RAB9A P51151 1/20 0.35
CRHR1 P34998 1/20 0.35

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
SCHEMBL4749202 0.83 LMNA (0.43) LMNAMAPTL3MBTL1POLBKMT2A
SCHEMBL26998829 0.79 KDM4E (0.38) MAPTKMT2A
SCHEMBL4748400 0.78 MAPT (0.52) LMNAMAPTL3MBTL1POLBCYP1A2
SCHEMBL25380852 0.76 CYP3A4 (0.37) MAPTL3MBTL1
SCHEMBL2092537 0.76 CYP2A6 (0.33) LMNAMEN1KMT2APARP1
SCHEMBL11088559 0.76 MAPT (0.60) LMNAMAPTL3MBTL1POLBCYP1A2
SCHEMBL5022784 0.76 LMNA (0.51) LMNAMAPTL3MBTL1POLBCYP1A2
SCHEMBL5412870 0.73 MAPT (0.47) LMNAMAPTL3MBTL1POLBCYP1A2
SCHEMBL10754312 0.73 PARP1 (0.47) LMNAMAPTL3MBTL1POLBMEN1
SCHEMBL11846851 0.72 LMNA (0.44) LMNAMAPTL3MBTL1POLBTP53

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-2008117079-A1 ANTIMICROBIAL COMPOUNDS BASED UPON 4-AMINOQUINOLINE HELPERBY THERAPEUTICS LIMITED (GB) 2008-10-02 WO disclosed