Benzene

Benzene

SCHEMBL9487554

C=C1COCCO1.c1ccccc1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
CRHBP P24387 2/20 0.39
CRHR2 Q13324 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
ITGB2 P05107 1/20 0.32
ICAM1 P05362 1/20 0.32
ITGAL P20701 1/20 0.32

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
SCHEMBL452778 0.92
SCHEMBL9787235 0.69 LMNA (0.61) LMNACRHBPCRHR2SMN1; SMN2HTT
Benzene SCHEMBL88326 0.65
SCHEMBL2572530 0.64
SCHEMBL4721673 0.64 LMNA (0.44) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL7908874 0.61
SCHEMBL9915833 0.61
Dioxane SCHEMBL4378083 0.61 TTR (0.67) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL268473 0.61
SCHEMBL4435964 0.59

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
US-5260183-A Cyanine dye, thiocyanate, triazolopyrimidine spectral sensitizer FUJI PHOTO FILM CO., LTD. (JP) 1993-11-09 US disclosed