SCHEMBL6540814

SCHEMBL6540814

c1ccc(-c2ccccc2N(c2ccccc2-c2ccccc2)c2ccc(N(c3ccccc3-c3ccccc3)c3ccccc3-c3ccccc3)c3ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
HPGD P15428 4/20 0.38
HSD17B10 Q99714 3/20 0.38
MAPK1 P28482 3/20 0.38
BCL2L1 Q07817 1/20 0.38
CYP2A6 P11509 1/20 0.38
LIMK1 P53667 2/20 0.36
CLK4 Q9HAZ1 2/20 0.36
CHEK1 O14757 1/20 0.36
NEK2 P51955 1/20 0.36
DYRK1A Q13627 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
PARP1 P09874 1/20 0.35
MAP4K4 O95819 1/20 0.35
CSF1R P07333 1/20 0.35
FGFR1 P11362 1/20 0.35
PDGFRA P16234 1/20 0.35
LTK P29376 1/20 0.35
KDR P35968 1/20 0.35

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
SCHEMBL5404983 0.89 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10MAPK1BCL2L1
SCHEMBL24861445 0.86 RXRA (0.45) ALDH1A1HPGDHSD17B10MAPK1BCL2L1
SCHEMBL24154430 0.84 RXRA (0.36) ALDH1A1HPGDHSD17B10MAPK1BCL2L1
SCHEMBL24251348 0.83 ALDH1A1 (0.33) ALDH1A1HPGDHSD17B10MAPK1BCL2L1
SCHEMBL22670258 0.81 ALDH1A1 (0.43) ALDH1A1HPGDHSD17B10MAPK1KDM4E
SCHEMBL25027776 0.81 ALDH1A1 (0.37) ALDH1A1HPGDHSD17B10MAPK1KDM4E
SCHEMBL30021368 0.80 MAPT (0.47) ALDH1A1HPGDHSD17B10MAPK1KDM4E
SCHEMBL26338901 0.80 RXRA (0.35) RXRARXRB
SCHEMBL22107905 0.80 CYP11B1 (0.40) ALDH1A1HPGDHSD17B10MAPK1RXRA
SCHEMBL22669939 0.80 ALDH1A1 (0.39) ALDH1A1HPGDHSD17B10MAPK1KDM4E

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-1452574-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME TOYO INK MFG. CO., LTD. (JP) 2004-09-01 EP disclosed
US-20040151944-A1 Anode, cathode, light emitting layers TOYO INK MFG. CO., LTD. (JP) 2004-08-05 US disclosed