SCHEMBL6541302

SCHEMBL6541302

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

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 4/20 0.35
DHFR P00374 1/20 0.35
GCGR P47871 2/20 0.35
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
PTPN1 P18031 1/20 0.33
HTR1A P08908 2/20 0.33
HTR7 P34969 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL6541589 0.95 SOAT1 (0.38) SOAT1DHFRGCGRPDCD1CD274
SCHEMBL6541719 0.94 SOAT1 (0.40) SOAT1DHFRGCGRPTPN1
SCHEMBL6541882 0.94 SOAT1 (0.40) SOAT1DHFRGCGRPTPN1
SCHEMBL6542038 0.94 SOAT1 (0.40) SOAT1DHFRGCGRPTPN1
SCHEMBL6541983 0.90 PDCD1 (0.36) DHFRPDCD1CD274HTR1AHTR7
SCHEMBL6542098 0.86 CASP3 (0.39) SOAT1PDCD1CD274PTPN1HTR7
SCHEMBL6541665 0.83 PDCD1 (0.38) DHFRPDCD1CD274HTR1AHTR7
SCHEMBL6540669 0.81 SOAT1 (0.41) SOAT1PTPN1
SCHEMBL6541303 0.80 SOAT1 (0.43) SOAT1PTPN1
SCHEMBL6540940 0.80 SOAT1 (0.43) SOAT1PTPN1

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