SCHEMBL13201436

SCHEMBL13201436

CCc1ccc(COO)o1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.39
RAB9A P51151 6/20 0.39
KMT2A Q03164 3/20 0.39
ALOX5 P09917 2/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
HSP90AA1 P07900 1/20 0.38
ALDH1A1 P00352 7/20 0.36
MEN1 O00255 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 2/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 3/20 0.35
GAA P10253 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SLC5A2 P31639 1/20 0.33
HTT P42858 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
SCHEMBL22446673 0.81 NPC1 (0.37) NPC1RAB9AKMT2AALOX5PTGS1
SCHEMBL45858 0.80
SCHEMBL19049630 0.79 ALOX5 (0.40) NPC1RAB9AKMT2AALOX5PTGS1
SCHEMBL17791258 0.77 ALOX5 (0.45) NPC1RAB9AKMT2AALOX5PTGS1
SCHEMBL17693429 0.77 ALDH1A1 (0.38) NPC1RAB9AKMT2AALOX5PTGS1
SCHEMBL257112 0.75 ALDH1A1 (0.53) NPC1RAB9AKMT2AHSP90AA1ALDH1A1
SCHEMBL17693435 0.74 ALDH1A1 (0.36) NPC1RAB9AKMT2AALOX5PTGS1
SCHEMBL8398400 0.72 NPC1 (0.43) NPC1RAB9AKMT2AALOX5HSP90AA1
SCHEMBL22446689 0.72 ALOX5 (0.36) NPC1RAB9AKMT2AALOX5PTGS1
SCHEMBL6473523 0.71 ELANE (0.46) NPC1RAB9AKMT2AHSP90AA1ALDH1A1

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-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed