SCHEMBL5709276

SCHEMBL5709276

NCc1ccc2c(n1)[nH]c1ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA5A P35218 1/20 0.62
ALDH1A1 P00352 5/20 0.43
HSD17B10 Q99714 2/20 0.43
GPR3 P46089 1/20 0.43
MAPT P10636 3/20 0.42
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
CASP1 P29466 1/20 0.42
RAB9A P51151 1/20 0.42
MAPK10 P53779 1/20 0.42
CASP7 P55210 1/20 0.42
KIF11 P52732 5/20 0.41
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
AHR P35869 1/20 0.38
KDM4E B2RXH2 3/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL31285916 0.83 CA5A (0.57) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL684360 0.80 CA5A (0.54) CA5AALDH1A1HSD17B10GPR3POLB
SCHEMBL30316010 0.79 CA5A (0.53) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL29623886 0.77 CA5A (1.00) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL1336334 0.77 CA5A (1.00) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL30316056 0.75 CA5A (0.49) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL30315795 0.75 CA5A (0.49) CA5AALDH1A1HSD17B10MAPTPOLB
SCHEMBL30315905 0.75 CA5A (0.49) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL30315901 0.75 CA5A (0.49) CA5AALDH1A1HSD17B10GPR3MAPT
SCHEMBL30315791 0.75 CA5A (0.49) CA5AALDH1A1HSD17B10MAPTPOLB

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1702935-A1 CROSSLINKED POLYMER HAVING PHTHALOCYANINE BONDED THERETO Showa Denko K.K. (JP) 2006-09-20 EP disclosed
EP-0434858-B1 Reaction product of a grafted dextranomer and a phthalocyanin dye and its use NESTLE SA (CH) 1994-02-23 EP disclosed
US-5179202-A REACTION PRODUCT OF GRAFTED DEXTRANOMER AND A PHTHALOCYANINE DYE NESTEC S.A. (CH) 1993-01-12 US disclosed
EP-0090610-B1 A METHOD FOR TREATMENT OF MUTAGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-07-01 EP disclosed
US-4623638-A CHROMATOGRAPHY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-11-18 US disclosed
EP-0157549-A2 Silica gel linked to a phthalocyanine compound and a method for treating polycyclic organic substances therewith SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-10-09 EP disclosed
US-4460475-A Method for treatment of mutagens SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-07-17 US disclosed
EP-0090610-A2 A method for treatment of mutagens SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-10-05 EP disclosed