Benzene

Benzene

SCHEMBL28260613

Nc1cccc(S)c1.Nc1cccc(S)c1.c1ccccc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.58
CASP1 P29466 1/20 0.58
RECQL P46063 1/20 0.58
MAOA P21397 4/20 0.50
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
CA7 P43166 1/20 0.46
TSHR P16473 2/20 0.45
MAOB P27338 4/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
CYP19A1 P11511 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44

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
Benzene SCHEMBL21624958 1.00 CYP3A4 (0.58) CYP3A4CASP1RECQLMAOAALDH1A1
SCHEMBL31099299 0.97
SCHEMBL61220 0.97
Hydrochloric Acid SCHEMBL28657534 0.94
SCHEMBL2960481 0.94
Methane SCHEMBL1639492 0.94
SCHEMBL27270310 0.94
Phenol SCHEMBL27588321 0.87 ALDH1A1 (0.58) CYP3A4CASP1RECQLMAOAALDH1A1
Benzenethiol SCHEMBL27818160 0.86 CYP3A4 (0.63) CYP3A4CASP1RECQLMAOAALDH1A1
SCHEMBL25975098 0.82 MAOA (0.62) CYP3A4CASP1RECQLMAOAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475859-A The method for inhibiting neural stem cell differentiating method, the method for preparation neural stem cell and induced nerve stem cells to break up UBE INDUSTRIES 2019-11-19 CN disclosed
CN-110099974-A Composition is used in the formation of substrate protective layer 日产化学株式会社 2019-08-06 CN disclosed
CN-110050013-A The manufacturing method of peeling layer 日产化学株式会社 2019-07-23 CN disclosed
CN-109563341-A Peeling layer formation composition for transparent resin substrate 日产化学株式会社 2019-04-02 CN disclosed
CN-109563300-A Method for producing porous polyimide film and porous polyimide film produced by the method 宇部兴产株式会社 2019-04-02 CN disclosed
CN-109562201-A For treating the implantation material of bone injury site and the treatment method of kit and bone injury site 宇部兴产株式会社 2019-04-02 CN disclosed
CN-109563465-A Cell culture apparatus and the cell culture processes for using the cell culture apparatus 宇部兴产株式会社 2019-04-02 CN disclosed
CN-109496231-A Cell culture apparatus and the cell culture processes for using it 宇部兴产株式会社 2019-03-19 CN disclosed
CN-109476912-A Composition for forming release layer 日产化学株式会社 2019-03-15 CN disclosed
CN-109477056-A Siphon cultivation method 宇部兴产株式会社 2019-03-15 CN disclosed
CN-109477055-A Preparation method, cell culture apparatus and the kit of cell 宇部兴产株式会社 2019-03-15 CN disclosed
CN-106133062-B Composition is used in peeling layer formation 日产化学工业株式会社 2019-02-19 CN disclosed
CN-109196051-A Peeling layer, which is formed, uses composition and peeling layer 日产化学株式会社 2019-01-11 CN disclosed
CN-109153851-A Peeling layer, which is formed, uses composition and peeling layer 日产化学株式会社 2019-01-04 CN disclosed
CN-109153852-A Peeling layer, which is formed, uses composition and peeling layer 日产化学株式会社 2019-01-04 CN disclosed