SCHEMBL28784167

SCHEMBL28784167

C(=Cc1cc(-c2ccccc2)c(C=Cc2ccccc2)c(C=Cc2ccccc2)c1C=Cc1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PELI1 Q96FA3 2/20 0.42
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41
NFE2L2 Q16236 5/20 0.41
TRPA1 O75762 2/20 0.41
RELA Q04206 1/20 0.41
CHAT P28329 1/20 0.38
MAOB P27338 3/20 0.37
CYP19A1 P11511 2/20 0.37
MAOA P21397 2/20 0.37
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP1B1 Q16678 1/20 0.37

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
SCHEMBL29713155 0.82 PELI1 (0.53) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL16738162 0.82 PELI1 (0.53) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL16738163 0.82 PELI1 (0.53) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL3992276 0.81 PTPN1 (0.53) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL11086928 0.81 CYP19A1 (0.42) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL2528155 0.76 PTPN1 (0.44) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL5680920 0.76 TRPA1 (0.57) PTPN1NFE2L2TRPA1
SCHEMBL5680917 0.76 TRPA1 (0.57) PTPN1NFE2L2TRPA1
SCHEMBL39009 0.76 NFE2L2 (0.47) PELI1PTPN1PTPN6NFE2L2TRPA1
SCHEMBL2033487 0.75 NFE2L2 (0.54) NFE2L2TRPA1RELACHATMAOB

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
CN-101771071-A Organic light emitting device SAMSUNG MOBILE DISPLAY CO LTD 2010-07-07 CN claimed
CN-101771071-B Organic light emitting apparatus SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-05 CN disclosed
CN-101771071-A Organic light emitting device SAMSUNG MOBILE DISPLAY CO LTD 2010-07-07 CN disclosed