SCHEMBL5028243

SCHEMBL5028243

CCn1c2c(c3cc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6CC)c4)ccc31)C=CCC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HBB P68871 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ NPY5R Q15761 6/20 0.43
▸ LMNA P02545 3/20 0.42
▸ TSPO P30536 1/20 0.41
▸ SRC P12931 2/20 0.40
▸ TP53 P04637 3/20 0.39
▸ POLB P06746 2/20 0.39
▸ RAC2 P15153 1/20 0.39
▸ RAC3 P60763 1/20 0.39
▸ CDC42 P60953 1/20 0.39

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
SCHEMBL12798400 0.85 SRC (0.47) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL10120763 0.83 SRC (0.50) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL26407841 0.83 KDM4E (0.47) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL23369890 0.82 SRC (0.49) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL20979222 0.82 ALDH1A1 (0.36) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL10042911 0.81 KDM4E (0.63) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL16482591 0.81 KDM4E (0.63) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL24667910 0.79 KDM4E (0.59) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL14141236 0.78 KDM4E (0.36) KDM4ETSPO
SCHEMBL17691795 0.77 KDM4E (0.58) MAPTKDM4EMEN1KMT2AHTT

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-2453496-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, NOVEL COMPOUND, LIGHTING DEVICE AND DISPLAY DEVICE Konica Minolta Holdings, Inc. (JP) 2012-05-16 — — EP disclosed
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