SCHEMBL2820215

SCHEMBL2820215

Nc1cc(C(=O)O)cc(C(=O)O)c1.Nc1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
DDO Q99489 1/20 0.56
TPMT P51580 3/20 0.55
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
LCK P06239 1/20 0.48
FYN P06241 1/20 0.48
TP53 P04637 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
CA3 P07451 1/20 0.48
MAPT P10636 1/20 0.48
SELL P14151 1/20 0.48

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
SCHEMBL223304 1.00 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
Water SCHEMBL17938300 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL2847323 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL2815377 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL8653192 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL613113 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9311860 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL28716938 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL31305036 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL28276290 0.97 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1942154-B1 WATER SOLUBLE AZO COMPOUND, INK COMPOSITION, AND COLORED MATERIAL NIPPON KAYAKU KK (JP) 2010-10-27 EP disclosed
US-7740696-B2 Water-soluble azo compound, ink composition, and colored article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-06-22 US disclosed
US-20090117341-A1 Water-Soluble Azo Compound, Ink Composition, and Colored Article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-05-07 US disclosed
EP-1942154-A1 WATER SOLUBLE AZO COMPOUND, INK COMPOSITION, AND COLORED MATERIAL Nippon Kayaku Kabushiki Kaisha (JP) 2008-07-09 EP disclosed