SCHEMBL20536802

SCHEMBL20536802

COCCC(=O)N1CCc2cc(C(=O)NCc3ccc(Cl)cc3)ccc2C1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
KMT2A Q03164 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
HTT P42858 2/20 0.47
HPGD P15428 2/20 0.47
NAMPT P43490 1/20 0.46
MAP3K5 Q99683 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TMPRSS2 O15393 1/20 0.45

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
SCHEMBL20537300 0.91 SMN1; SMN2 (0.53) SMN1; SMN2KMT2ATDP1L3MBTL1MAPT
SCHEMBL20537308 0.90 KDM4E (0.54) KDM4ESMN1; SMN2KMT2ATDP1L3MBTL1
SCHEMBL20537054 0.86 KMT2A (0.57) SMN1; SMN2KMT2ATDP1L3MBTL1MAPT
SCHEMBL14871702 0.86 KDM4E (0.60) KDM4ESMN1; SMN2KMT2ATDP1MAPT
SCHEMBL20536799 0.83 KMT2A (0.53) SMN1; SMN2KMT2ATDP1MAPTNAMPT
SCHEMBL20536415 0.81 L3MBTL1 (0.53) SMN1; SMN2KMT2ATDP1L3MBTL1MAPT
SCHEMBL1788003 0.78 SMN1; SMN2 (0.53) SMN1; SMN2KMT2ATDP1L3MBTL1MAPT
SCHEMBL20536797 0.77 MAPT (0.61) SMN1; SMN2MAPT
SCHEMBL1950717 0.76 KMT2A (0.49) KDM4EKMT2ATDP1MAPTNPSR1
SCHEMBL14871708 0.76 KDM4E (0.62) KDM4ESMN1; SMN2KMT2ANPSR1HPGD

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-2438055-B1 DIHYDROINDOLE AND TETRAHYDROISOQUINOLINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL INHIBITORS JAPAN TOBACCO INC (JP) 2018-10-24 EP claimed