SCHEMBL9704587

SCHEMBL9704587

Cc1c(Cl)nc(Cl)c(C(N)=O)c1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.55
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.37
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
PKMYT1 Q99640 3/20 0.34
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
EPHB4 P54760 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
WEE1 P30291 1/20 0.31

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
SCHEMBL31518421 0.80 ALDH1A1 (0.53) POLBALDH1A1MAPK1SMN1; SMN2KMT2A
SCHEMBL17008019 0.80 ALDH1A1 (0.53) POLBALDH1A1MAPK1SMN1; SMN2KMT2A
SCHEMBL21906012 0.79 POLB (0.52) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL30366735 0.76 POLB (0.47) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL19878657 0.76 POLB (0.47) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL19023262 0.75 NPSR1 (0.41) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL8889049 0.75 POLB (0.44) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL11949168 0.74 POLB (0.41) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL27448979 0.74 POLB (0.50) POLBALDH1A1MAPK1SMN1; SMN2MAPT
SCHEMBL14434331 0.73 POLB (0.48) POLBALDH1A1MAPK1SMN1; SMN2MAPT

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
EP-0482481-A1 Method for the preparation of 5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepines BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1992-04-29 EP disclosed