SCHEMBL13950894

SCHEMBL13950894

c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3nc4ccccc4nc3-c3ccccc3)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.78
L3MBTL1 Q9Y468 6/20 0.78
LMNA P02545 4/20 0.78
GAA P10253 3/20 0.78
TDP1 Q9NUW8 2/20 0.78
KMT2A Q03164 2/20 0.78
MEN1 O00255 1/20 0.78
ALDH1A1 P00352 6/20 0.69
NPSR1 Q6W5P4 1/20 0.69
PKM P14618 1/20 0.67
AKT1 P31749 1/20 0.64
AKT2 P31751 1/20 0.64
THRB P10828 1/20 0.60
ATM Q13315 1/20 0.59
TLR9 Q9NR96 1/20 0.59
MAPK10 P53779 1/20 0.57
MAPK14 Q16539 1/20 0.57
PDE10A Q9Y233 1/20 0.54
NPC1 O15118 1/20 0.53
HPGD P15428 1/20 0.53

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
SCHEMBL22769174 0.97 KDM4E (0.75) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL22769176 0.97 KDM4E (0.75) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL13726198 0.97 KDM4E (0.75) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL24590007 0.97 KDM4E (0.75) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL29382173 0.97 KDM4E (0.74) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL732131 0.97 KDM4E (0.74) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL865711 0.94 KDM4E (0.71) KDM4EL3MBTL1LMNAGAATDP1
Water SCHEMBL27680271 0.94 KDM4E (0.71) KDM4EL3MBTL1LMNAGAATDP1
SCHEMBL28710728 0.94 KDM4E (0.71) KDM4EL3MBTL1LMNAGAATDP1
Bromide SCHEMBL27580121 0.92 KDM4E (0.68) KDM4EL3MBTL1LMNAGAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1640402-B1 DIAMINE HAVING QUINOXALINE UNIT, POLYIMIDE PRECURSOR, POLYIMIDE AND USE THEREOF NISSAN CHEMICAL IND LTD (JP) 2009-02-11 EP disclosed