SCHEMBL9458185

SCHEMBL9458185

COc1cccc(/C=N/NC(=N)C(=N)N/N=C/c2cccc(OC)c2O)c1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.74
MAPT P10636 9/20 0.74
SMN1; SMN2 Q16637 6/20 0.74
HTT P42858 6/20 0.74
NPC1 O15118 5/20 0.74
LMNA P02545 5/20 0.74
L3MBTL1 Q9Y468 4/20 0.74
RECQL P46063 2/20 0.74
POLB P06746 1/20 0.74
KMT2A Q03164 6/20 0.61
MEN1 O00255 4/20 0.61
ADORA2A P29274 1/20 0.61
CA12 O43570 1/20 0.59
HPGD P15428 1/20 0.58
ALOX12 P18054 1/20 0.58
GAA P10253 5/20 0.57
RAB9A P51151 3/20 0.57
PKM P14618 3/20 0.57
GFER P55789 1/20 0.57
TDP1 Q9NUW8 2/20 0.56

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
SCHEMBL7748708 0.88 KDM4E (0.70) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL7748712 0.88 KDM4E (0.70) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL13673518 0.87 KDM4E (0.68) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL13673521 0.87 KDM4E (0.68) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL9458202 0.84 NCOA3 (0.61) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL19936663 0.83 MAPT (0.70) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL28223411 0.82 KDM4E (0.70) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL19519011 0.81 POLB (0.86) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL13673522 0.81 KDM4E (0.68) KDM4EMAPTSMN1; SMN2HTTNPC1
SCHEMBL15677695 0.81 KDM4E (0.68) KDM4EMAPTSMN1; SMN2HTTNPC1

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
US-5204311-A Yellow colored coordination compounds of transition metals MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-04-20 US disclosed
EP-0531020-A1 Ethanediimidic acid bis arylalkylidene)hydrazide MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-03-10 EP disclosed