SCHEMBL13645541

SCHEMBL13645541

C=C/C=C\c1cccc(I)c1C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.32

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
SCHEMBL28111954 0.80 TRPA1 (0.37)
SCHEMBL18434317 0.80 TRPA1 (0.37)
SCHEMBL10459304 0.79 ALDH1A1 (0.38) APP
SCHEMBL18468642 0.78 ESR1 (0.35) APP
SCHEMBL13445195 0.77 KDM1A (0.32)
SCHEMBL23707435 0.77 NFE2L2 (0.40)
SCHEMBL13210354 0.77 CYP3A4 (0.48)
SCHEMBL26743106 0.77
SCHEMBL14049586 0.77 TRPA1 (0.43)
SCHEMBL25555199 0.76 NFE2L2 (0.46)

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-2108690-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-10-14 EP disclosed
EP-2075309-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-07-01 EP disclosed