Benzene

Benzene

SCHEMBL28005151

c1ccc(-c2nc3ccccc3[nH]2)cc1.c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 1.00
RAB9A P51151 8/20 1.00
GAA P10253 2/20 1.00
KDM4E B2RXH2 13/20 0.75
ALDH1A1 P00352 12/20 0.75
SMN1; SMN2 Q16637 9/20 0.75
HSD17B10 Q99714 7/20 0.75
TP53 P04637 5/20 0.75
PKM P14618 2/20 0.75
PKN1 Q16512 1/20 0.75
PKN2 Q16513 1/20 0.75
ABCB11 O95342 1/20 0.75
NPSR1 Q6W5P4 1/20 0.75
HPGD P15428 10/20 0.72
MAPT P10636 5/20 0.72
GFER P55789 2/20 0.72
POLB P06746 1/20 0.72
LDHA P00338 1/20 0.68
EPHX2 P34913 1/20 0.68
KMT2A Q03164 3/20 0.67

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
SCHEMBL105095 1.00 NPC1 (1.00) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL16416275 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
Hydrogen Sulfide SCHEMBL28075074 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
Potassium SCHEMBL4891434 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL2147022 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL467859 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL4775610 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL27926515 0.98 NPC1 (0.96) NPC1RAB9AGAAKDM4EALDH1A1
SCHEMBL2252555 0.96 NPC1 (0.92) NPC1RAB9AGAAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL2147086 0.96 NPC1 (0.92) NPC1RAB9AGAAKDM4EALDH1A1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114716464-B Red light material based on aza beta diketone boron difluoride central core, preparation method and application thereof, and organic electroluminescent device 安徽秀朗新材料科技有限公司 2024-04-30 CN disclosed
CN-114805411-B Red light material based on aza-boron dipyrrole center core, preparation method and application thereof, and organic electroluminescent device 安徽秀朗新材料科技有限公司 2024-04-26 CN disclosed
CN-117820345-A Blue light material based on dibenzofuran-aza condensed ring, preparation and application thereof 山西大同大学 2024-04-05 CN disclosed
CN-114634494-B Dicyanopyrazine compound, preparation method and application thereof, organic electroluminescent device and application thereof 安徽秀朗新材料科技有限公司 2023-08-11 CN disclosed
CN-114805411-A Red light material based on aza-BODIPY central core, preparation method and application thereof, and organic electroluminescent device 安徽秀朗新材料科技有限公司 2022-07-29 CN disclosed
CN-114716464-A Red light material based on aza-beta-diketone boron difluoride central core, preparation method and application thereof, and organic electroluminescent device 安徽秀朗新材料科技有限公司 2022-07-08 CN disclosed
CN-114702446-A Efficient narrow-band deep blue photothermal activation type delayed fluorescent material and preparation and application thereof 山西华辉光电科技有限公司 2022-07-05 CN disclosed
CN-114634494-A Dicyanopyrazine compound, preparation method and application thereof, organic electroluminescent device and application thereof 安徽秀朗新材料科技有限公司 2022-06-17 CN disclosed
CN-114195781-A Pyridopyrazine compound and preparation method and application thereof 安徽秀朗新材料科技有限公司 2022-03-18 CN disclosed
CN-108912053-A A kind of luminous organic material with distortion molecular structure and its application in organic electroluminescence device 吉林大学 2018-11-30 CN disclosed
CN-104804727-B Phenanthroimidazole derivative based luminescent material and application of material in electroluminescent device 吉林大学 2017-03-22 CN disclosed
CN-104830320-B Phenanthreneopyrazine derivative luminescent material and application thereof in electroluminescent device 吉林大学 2017-03-22 CN disclosed
CN-104835916-B A kind of organic electroluminescence device of the luminescent layer that adulterated based on fluorescence 吉林大学 2017-03-08 CN disclosed
CN-105777649-A Aggregation-induced emissive material of triphenylethenyl-substituted phenanthroimidazole derivatives and application of aggregation-induced emissive material in preparation of organic electroluminescence device 吉林大学 2016-07-20 CN disclosed
CN-105647522-A Phenanthroimidazole-anthracene-diphenylamine derivative luminescent material and application thereof in preparation of organic electroluminescence devices 吉林大学 2016-06-08 CN disclosed
CN-104835916-A Highly-efficient organic electroluminescent device based on fluorescence doped luminescent layer UNIV JILIN 2015-08-12 CN disclosed
CN-104830320-A Phenanthreneopyrazine derivative luminescent material and application thereof in electroluminescent device UNIV JILIN 2015-08-12 CN disclosed
CN-104804727-A Phenanthroimidazole derivative based luminescent material and application of material in electroluminescent device UNIV JILIN 2015-07-29 CN disclosed