SCHEMBL3360324

SCHEMBL3360324

Cc1[nH]c(Cc2ccc(Cl)cc2)nc1-c1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
PRNP P04156 1/20 0.51
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
C5AR1 P21730 1/20 0.41
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PTGS2 P35354 1/20 0.38
NR1H2 P55055 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 2/20 0.38
BCHE P06276 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
ALOX15 P16050 1/20 0.36

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
SCHEMBL3363077 0.89 KMT2A (0.48) MAPTALDH1A1NPC1GAARAB9A
SCHEMBL27915186 0.88 PRNP (0.39) MAPTPRNPALDH1A1NPC1GAA
SCHEMBL3360696 0.87 PDE5A (0.43) MAPTPRNPKMT2AMEN1
SCHEMBL2873539 0.86 MAPT (0.50) MAPTPRNPGAAMAPK1L3MBTL1
SCHEMBL27933696 0.86 ADORA2A (0.44) MAPTPRNPALDH1A1RAB9ALMNA
SCHEMBL2864161 0.84 PRNP (0.45) MAPTPRNPRAB9AMAPK1L3MBTL1
SCHEMBL27915193 0.84 KMT2A (0.43) MAPTALDH1A1LMNAKMT2ABCHE
SCHEMBL27933833 0.84 MAPT (0.38) MAPTPRNPALDH1A1RAB9ALMNA
SCHEMBL27915185 0.84 HTT (0.42) MAPTL3MBTL1LMNAKDM4EHTT
SCHEMBL3359061 0.83 KDM4E (0.50) MAPTALDH1A1PTGS2LMNAKMT2A

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-2010024421-A1 SURFACE TREATING AGENT FOR COPPER OR COPPER ALLOY AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2010-03-04 WO disclosed