SCHEMBL7569676

SCHEMBL7569676

CCCCC(CCCOC(N)=O)OC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 2/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
LMNA P02545 3/20 0.38
HSD17B10 Q99714 1/20 0.38
ACHE P22303 1/20 0.38
BACE1 P56817 1/20 0.38
CTSK P43235 1/20 0.37
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM5 P08912 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
TSHR P16473 2/20 0.37
HTR1A P08908 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
SCHEMBL7563877 0.93 NAAA (0.42) CHRNB2CHRNA4CHRNB4CHRNA3CA1
SCHEMBL7564855 0.93 CHRNB2 (0.41) CHRNB2CHRNA4CHRNB4CHRNA3CA1
SCHEMBL7570220 0.87 CHRNB2 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3CA1
SCHEMBL7570273 0.86 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB4CHRNA3ALOX15
SCHEMBL10935542 0.85 CTSK (0.49) CA1CA2LMNACTSKCHRM2
SCHEMBL4856250 0.85 CA1 (0.45) CA1CA2CTSKMAPT
SCHEMBL4856594 0.83 CA2 (0.46) CA1CA2ALDH1A1LMNAMAPT
SCHEMBL5953699 0.83 CA2 (0.46) CA1CA2ALDH1A1LMNAMAPT
SCHEMBL10844707 0.83 GPR84 (0.42) CA1CA2LMNAMAPT
SCHEMBL28527259 0.81 CA2 (0.42) CA1CA2ALDH1A1LMNACTSK

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-0855393-B1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KK (JP) 2002-08-14 EP disclosed
US-5922882-A ULTRAVIOLET RADIATION ABSORBER; COPOLYMERIZATION COMPONENT OF BISBENZOTRIAZOLE COMPRISING A COPOLYCARBONATE, A COPOLYESTER, A COPOLYURETHANE AND A COPOLYURETHANEURA OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1999-07-13 US disclosed
EP-0855393-A1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1998-07-29 EP disclosed