SCHEMBL8152254

SCHEMBL8152254

FCC(F)(F)Oc1ccc2ccccc2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC1 Q13547 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
NCF1 P14598 3/20 0.37
NOS2 P35228 1/20 0.37
BACE1 P56817 1/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYSLTR2 Q9NS75 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
CNR2 P34972 1/20 0.35
MGAM O43451 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL2540903 0.82 SMN1; SMN2 (0.46) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL31325635 0.82 SMN1; SMN2 (0.46) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL28628097 0.74 MEN1 (0.56) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL4278377 0.74 CYP1A2 (0.47) MEN1MAPTKMT2ANCF1NOS2
SCHEMBL6607250 0.74 MEN1 (0.51) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL9663555 0.71 MAPT (0.61) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL6600702 0.71 MEN1 (0.56) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL1131286 0.71 NCF1 (0.50) MEN1MAPTKMT2ANCF1NOS2
SCHEMBL31498821 0.71 NCF1 (0.50) MEN1MAPTKMT2ANCF1NOS2
SCHEMBL2744806 0.70 CYP1A2 (0.42) MEN1MAPTKMT2ANCF1NOS2

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
EP-1009748-A1 3-ALKYLPYRROLO 3,2-$i(c)]QUINOLINE DERIVATIVES Korea Research Institute of Chemical Technology (KR) 2000-06-21 EP disclosed
WO-2000001696-A1 3-ALKYLPYRROLO[3,2-c]QUINOLINE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2000-01-13 WO disclosed