SCHEMBL13645518

SCHEMBL13645518

C=CC1=C(/C=C\CI)c2ccccc2C1(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL20130955 0.82 MEN1 (0.39) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL21120326 0.81 MEN1 (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL24700749 0.78
SCHEMBL20967554 0.72 MEN1 (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23517066 0.71 MEN1 (0.36) MEN1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL22580722 0.71 MEN1 (0.40) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL24685104 0.70
SCHEMBL22363970 0.70
SCHEMBL19152014 0.70 MEN1 (0.38) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL19669965 0.70 PDK2 (0.36) KDM4EMEN1LMNAMAPTOPRK1

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 1 patent. 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