SCHEMBL6540764

SCHEMBL6540764

C[N]c1cccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
HNF4A P41235 1/20 0.37
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 2/20 0.37
HPGD P15428 1/20 0.37
BCL2L1 Q07817 1/20 0.37
CYP2A6 P11509 1/20 0.37
MAPK1 P28482 1/20 0.37
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
SIGMAR1 Q99720 2/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL5012498 0.83 CASP3 (0.41) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL6541022 0.82 CASP3 (0.48) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL5008914 0.79 CASP3 (0.42) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL6657737 0.79 CASP3 (0.57) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL6541665 0.79 PDCD1 (0.38) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL6542117 0.78 CASP3 (0.46) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL192418 0.77 ALDH1A1 (0.50) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL3266658 0.76 CASP3 (0.63) CASP3SENP8SENP7SENP6HNF4A
SCHEMBL6541983 0.76 PDCD1 (0.36) CASP3SENP8SENP7SENP6PDCD1
SCHEMBL1680277 0.76 CASP3 (0.57) CASP3SENP8SENP7SENP6PDCD1

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