SCHEMBL9350877

SCHEMBL9350877

c1nc(N2CCOCC2)c2nc(N3CCOCC3)nc(N3CCOCC3)c2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
GAA P10253 2/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPK1 P28482 4/20 0.48
HPGD P15428 2/20 0.48
GLA P06280 1/20 0.48
PIK3CA P42336 6/20 0.47
PIK3R1 P27986 3/20 0.47
TSHR P16473 1/20 0.47
PTK2 Q05397 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CHEK1 O14757 1/20 0.45
PDPK1 O15530 1/20 0.45
PAK1 Q13153 1/20 0.45
JAK3 P52333 1/20 0.44
SLC29A1 Q99808 1/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL9350940 0.88 KDM4E (0.53) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL9229772 0.85 PIK3CD (0.42) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL9351961 0.84 HTT (0.44) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL10661157 0.83 TSHR (0.44) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL7938993 0.82 KDM4E (0.49) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL10659846 0.81 KDM4E (0.49) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL10662883 0.81 PIK3R1 (0.48) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL9350978 0.81 ALDH1A1 (0.59) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL10662751 0.80 CYP1A2 (0.39) KDM4EGAAALDH1A1MAPK1HPGD
SCHEMBL10660194 0.78 ALDH1A1 (0.39) KDM4EGAAALDH1A1MAPK1HPGD

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
US-5346772-A HAVING A HIGH LUMINANCE AND HIGH EMISSION EFFICIENCY PIONEER ELECTRONIC CORPORATION (JP) 1994-09-13 US claimed
US-5346772-A HAVING A HIGH LUMINANCE AND HIGH EMISSION EFFICIENCY PIONEER ELECTRONIC CORPORATION (JP) 1994-09-13 US disclosed
EP-0583861-A1 Organic electroluminescene device PIONEER ELECTRONIC CORPORATION (JP) 1994-02-23 EP disclosed