SCHEMBL10083046

SCHEMBL10083046

C1=Cc2c(sc3ccc(-c4c5ccccc5c(-c5ccccc5-c5ccc6ccccc6c5)c5ccccc45)cc23)CC1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 4/20 0.32
S1PR5 Q9H228 4/20 0.32
HDAC4 P56524 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
GSTP1 P09211 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MET P08581 1/20 0.30
GPR84 Q9NQS5 1/20 0.30

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
SCHEMBL23967918 0.90 PIM3 (0.33)
SCHEMBL10083907 0.89 PIM3 (0.36)
SCHEMBL23967916 0.86 PIM3 (0.31)
SCHEMBL23967836 0.85 CA12 (0.34) HDAC8
SCHEMBL12839867 0.84 PIM3 (0.32)
SCHEMBL23967765 0.82 PIM3 (0.36)
SCHEMBL1755455 0.81
SCHEMBL10083102 0.81 PIM3 (0.30)
SCHEMBL19142000 0.79 S1PR5 (0.32) S1PR4S1PR5
SCHEMBL13271316 0.78

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-2423206-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME Idemitsu Kosan Co., Ltd. (JP) 2012-02-29 EP disclosed