SCHEMBL10570570

SCHEMBL10570570

Cc1ccc(N2N=C3c4cc(C)ccc4SCCC3CC2=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.37
MAPT P10636 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HTT P42858 3/20 0.35
LMNA P02545 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GAA P10253 3/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
GRM5 P41594 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL7297582 0.93 MAPT (0.41) KDM4EMAPTSMN1; SMN2HTTLMNA
SCHEMBL7297497 0.91 MAOA (0.33) KDM4EMAPTSMN1; SMN2HTTLMNA
SCHEMBL7292065 0.88 HTT (0.37) KDM4EMAPTSMN1; SMN2HTTGAA
SCHEMBL7297343 0.86 CNR2 (0.34) KDM4ESMN1; SMN2GAAPOLBPDE4A
SCHEMBL7286803 0.85 VHL (0.42) KDM4EMAPTSMN1; SMN2HTTLMNA
SCHEMBL7286064 0.84 MAPT (0.39) KDM4EMAPTSMN1; SMN2HTTLMNA
SCHEMBL10558711 0.82 MAPT (0.43) KDM4EMAPTSMN1; SMN2HTTLMNA
SCHEMBL9864982 0.82 KDM4E (0.40) KDM4EMAPTSMN1; SMN2HTTLMNA
SCHEMBL7379926 0.82 MAPT (0.33) KDM4EMAPTHTTLMNAGAA
SCHEMBL7288749 0.81 GRM5 (0.36) MAPTSMN1; SMN2HTTLMNAGAA

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
US-4849421-A SIDE EFFECT REDUCTION YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-07-18 US disclosed