Benzene

Benzene

SCHEMBL6080938

C#Cc1c(C(=O)O)nc2c(OC)ccc(C)c2c1O.c1ccccc1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
PDE4B Q07343 2/20 0.35
PDE10A Q9Y233 1/20 0.34
RNASEH1 O60930 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 2/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.34
CDK9 P50750 1/20 0.33
DYRK1A Q13627 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
TGM2 P21980 1/20 0.33
PDE4A P27815 1/20 0.33

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
SCHEMBL6081049 0.82 MAPT (0.42) MAPTKDM4EL3MBTL1PDE4BPDE10A
Benzene SCHEMBL6594689 0.80 PDE10A (0.46) MAPTKDM4EL3MBTL1PDE4BPDE10A
SCHEMBL6081015 0.76 KDM4E (0.42) MAPTKDM4EL3MBTL1PDE4BRNASEH1
SCHEMBL6081119 0.69 RNASEH1 (0.44) MAPTKDM4EL3MBTL1PDE4BRNASEH1
SCHEMBL6592438 0.69 GPR35 (0.51) MAPTKDM4EL3MBTL1PDE10ATDP1
SCHEMBL6079769 0.67 KDM4E (0.38) MAPTKDM4EL3MBTL1PDE4BRNASEH1
SCHEMBL6080920 0.66 PDE10A (0.50) MAPTKDM4EL3MBTL1PDE4BPDE10A
SCHEMBL6080525 0.66 PTGER1 (0.46) MAPTL3MBTL1TDP1SMN1; SMN2
SCHEMBL6079920 0.65 HPGDS (0.47) MAPTKDM4EL3MBTL1PDE10ALMNA
SCHEMBL6080250 0.64 DHODH (0.41) MAPTKDM4EL3MBTL1PDE4BLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US claimed
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL MAPT 1575/4885KDM4E 1006/4885L3MBTL1 4069/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.