Benzene

Benzene

SCHEMBL28187995

O=C1c2ccccc2-c2ccccc21.c1ccccc1

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.86
KMT2A Q03164 3/20 0.86
CDC25B P30305 2/20 0.86
LMNA P02545 4/20 0.80
MAPT P10636 4/20 0.80
RAB9A P51151 4/20 0.80
SMN1; SMN2 Q16637 4/20 0.80
S100A4 P26447 3/20 0.80
APAF1 O14727 3/20 0.80
TDP2 O95551 3/20 0.80
BLM P54132 3/20 0.80
NPC1 O15118 3/20 0.80
HTT P42858 3/20 0.80
MAOA P21397 3/20 0.80
THRB P10828 2/20 0.80
GALK1 P51570 2/20 0.80
NPSR1 Q6W5P4 2/20 0.80
KDM4E B2RXH2 2/20 0.80
POLB P06746 2/20 0.80
PLA2G1B P04054 2/20 0.80

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
SCHEMBL31884 0.96 MEN1 (0.92) MEN1KMT2ACDC25BLMNAMAPT
SCHEMBL29378679 0.96 MEN1 (0.92) MEN1KMT2ACDC25BLMNAMAPT
SCHEMBL20203661 0.96 MEN1 (0.92) MEN1KMT2ACDC25BLMNAMAPT
SCHEMBL30479684 0.96 MEN1 (0.92) MEN1KMT2ACDC25BLMNAMAPT
Anthraquinone SCHEMBL183074 0.93 MEN1 (0.86) MEN1KMT2ACDC25BLMNAMAPT
9,10-Phenanthrenequinone SCHEMBL11634370 0.93 S100A4 (0.93) MEN1KMT2ACDC25BLMNAMAPT
Water SCHEMBL7789828 0.93 MEN1 (0.86) MEN1KMT2ACDC25BLMNAMAPT
SCHEMBL29615309 0.93 MEN1 (0.86) MEN1KMT2ACDC25BLMNAMAPT
SCHEMBL678825 0.93 MEN1 (0.86) MEN1KMT2ACDC25BLMNAMAPT
9,10-Phenanthrenequinone SCHEMBL29746976 0.93 S100A4 (0.93) MEN1KMT2ACDC25BLMNAMAPT

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
CN-107431137-A Functional layer formation composition and its manufacture method, the manufacture method of organic EL element, organic el device, electronic equipment 精工爱普生株式会社 2017-12-01 CN disclosed