SCHEMBL6563922

SCHEMBL6563922

CCOc1ccc2nc(-c3ccc4cc(-c5nc6ccc(OCC)cc6c(=O)o5)ccc4c3)oc(=O)c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
MAPT P10636 6/20 0.67
TP53 P04637 5/20 0.67
NPC1 O15118 3/20 0.67
RAB9A P51151 2/20 0.67
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
KDM4E B2RXH2 6/20 0.50
LMNA P02545 1/20 0.50
HSD17B10 Q99714 3/20 0.49
HPGD P15428 5/20 0.49
CYP1A2 P05177 2/20 0.49
TSHR P16473 1/20 0.49
CTSG P08311 1/20 0.48
KLK7 P49862 1/20 0.48
KLK14 Q9P0G3 1/20 0.48
KLK5 Q9Y337 1/20 0.48
C1R P00736 1/20 0.47
F2 P00734 1/20 0.47

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
SCHEMBL6563940 0.95 SMN1; SMN2 (0.74) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL6563993 0.85 MAPT (0.65) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL6565596 0.81 HPN (0.56) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL6565635 0.81 POLB (0.67) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL17254726 0.81 MAPT (0.53) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL914228 0.80 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL2537004 0.79 MAPT (0.72) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL6567424 0.79 ELANE (0.62) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL6566018 0.77 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2MAPTTP53NPC1
SCHEMBL6567281 0.77 MAPT (0.50) ALDH1A1SMN1; SMN2MAPTTP53NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0993965-B1 Thermally sensitive recording medium JUJO PAPER CO LTD (JP) 2004-03-31 EP disclosed
US-6440897-B1 BIS-BENZOXAZINONE COMPOUND AS AN ULTRAVIOLET RAY ABSORBING AGENT NIPPON PAPER INDUSTRIES CO LTD (JP) 2002-08-27 US disclosed
EP-0993965-A2 Thermally sensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2000-04-19 EP disclosed