SCHEMBL18944716

SCHEMBL18944716

C1=Cc2c(c3cc4c(cc3n2-c2cccc(-c3ccccc3)n2)c2ccccc2n4-c2cccc(-c3ccccc3)n2)CC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
COMT P21964 1/20 0.34
MEN1 O00255 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL13466705 0.91
SCHEMBL14136190 0.91 KDM4E (0.38)
SCHEMBL19849099 0.85 KDM4E (0.40)
SCHEMBL18944725 0.84 MKNK1 (0.31)
SCHEMBL13466236 0.84 KDM4E (0.39)
SCHEMBL20612770 0.83 COMT (0.33) COMTMEN1RAB9AKMT2A
SCHEMBL18155802 0.83 PIM1 (0.30)
SCHEMBL13465852 0.83 KDM4E (0.35)
SCHEMBL20123300 0.83 MKNK1 (0.33)
SCHEMBL10027563 0.82 MEN1 (0.46) COMTMEN1RAB9AKMT2A

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-3176241-A1 ORGANIC LIGHT-EMITTING MATERIAL AND ORGANIC LIGHT-EMITTING ELEMENT Nippon Steel & Sumikin Chemical Co., Ltd. (JP) 2017-06-07 EP disclosed