SCHEMBL10653293

SCHEMBL10653293

C(=Cc1ccc(-n2cccn2)cc1)c1ccc(-n2cccn2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.72
ALDH1A1 P00352 3/20 0.72
MAPK1 P28482 2/20 0.72
NOTUM Q6P988 1/20 0.62
HDAC4 P56524 1/20 0.44
CHRNA7 P36544 1/20 0.44
CHRNA10 Q9GZZ6 1/20 0.44
CHRNA9 Q9UGM1 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
CHRM1 P11229 1/20 0.40
NAMPT P43490 1/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
G6PD P11413 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL11410050 1.00 KDM4E (0.72) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL16549641 0.93 KDM4E (0.64) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL21428687 0.89 KDM4E (0.64) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL4818138 0.89 KDM4E (0.64) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL4341894 0.87 NOTUM (0.78) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL19979604 0.86 KDM4E (0.70) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL6850578 0.86 ALDH1A1 (0.70) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL6871245 0.86 ALDH1A1 (0.70) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL24784704 0.84 KDM4E (0.58) KDM4EALDH1A1MAPK1NOTUMHDAC4
SCHEMBL7028415 0.84 KDM4E (0.58) KDM4EALDH1A1MAPK1NOTUMHDAC4

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-0045279-B1 AMINE OXIDE COMPOUNDS, PROCESSES FOR THEIR MANUFACTURE AND THEIR USE AS OPTICAL BRIGHTENERS CIBA-GEIGY AG (CH) 1988-06-01 EP claimed
US-4539161-A OPTICAL BRIGHTNERS, FLUORESCENT DYES CIBA-GEIGY CORPORATION (US) 1985-09-03 US disclosed
US-4263431-A ARYL QUATERNARY AMINE PHOSPHONATE DERIVATIVES CIBA-GEIGY CORPORATION (US) 1981-04-21 US disclosed