SCHEMBL7063849

SCHEMBL7063849

Cc1cc(O)n(N)c(=O)c1C#N.[KH]

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.49
LMNA P02545 4/20 0.49
USP2 O75604 2/20 0.46
UPP1 Q16831 1/20 0.46
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HPGD P15428 1/20 0.44
MAPT P10636 3/20 0.42
THRB P10828 1/20 0.42
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL7061378 0.98 KDM4E (0.50) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL16401492 0.81 KDM4E (0.61) KDM4ELMNAUSP2MEN1KMT2A
SCHEMBL4614217 0.78 KDM4E (0.53) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL17949841 0.76 KDM4E (0.60) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL1413217 0.75 KDM4E (0.72) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL5651203 0.75 KDM4E (0.66) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL6562559 0.75 KDM4E (0.54) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL8043774 0.75 KDM4E (0.50) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL11472827 0.74 KDM4E (0.47) KDM4ELMNAUSP2UPP1MEN1
SCHEMBL10766144 0.74 KDM4E (0.57) KDM4ELMNAUSP2UPP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1312986-A1 Magenta-colored toner particles for electrostatographic imaging NexPress Solutions LLC (US) 2003-05-21 EP disclosed
US-6528223-B1 Particle composition comprising binder polymer and specified dye having various substituents introduced into aromatic ring at thiazolyl 4-position, to avoid tendency toward dye crystallization NEXPRESS SOLUTIONS LLC 2003-03-04 US disclosed