SCHEMBL3773204

SCHEMBL3773204

COC(=O)C=Cc1cc(OC)c(OC)c(OC)c1S(=O)(=O)Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.44
GABRB2 P47870 1/20 0.44
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HTR1A P08908 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
HTR2C P28335 1/20 0.42
EPHX2 P34913 1/20 0.42
NFE2L2 Q16236 2/20 0.41
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL3773201 1.00 GABRA1 (0.44) GABRA1GABRB2ALDH1A1KDM4EHTR1A
SCHEMBL3764112 0.81 MAPT (0.43) ALDH1A1KDM4EHPGDHSD17B10EPHX2
SCHEMBL3764106 0.81 MAPT (0.43) ALDH1A1KDM4EHPGDHSD17B10EPHX2
SCHEMBL3763460 0.79 NFE2L2 (0.47) GABRA1GABRB2ALDH1A1KDM4EHPGD
SCHEMBL3763457 0.79 NFE2L2 (0.47) GABRA1GABRB2ALDH1A1KDM4EHPGD
SCHEMBL2433925 0.75 ALDH1A1 (0.72) ALDH1A1KDM4EHTR1AHPGDHSD17B10
SCHEMBL2433926 0.75 ALDH1A1 (0.72) ALDH1A1KDM4EHTR1AHPGDHSD17B10
SCHEMBL3675047 0.73 NFE2L2 (0.73) GABRA1GABRB2ALDH1A1KDM4EHPGD
SCHEMBL3675045 0.73 NFE2L2 (0.73) GABRA1GABRB2ALDH1A1KDM4EHPGD
SCHEMBL1879320 0.72 ABCG2 (0.69) EPHX2NFE2L2MAPTTP53CYP1A2

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-20100311741-A1 Bicyclosulfonyl Acid (BCSA) Compounds and Their Use as Therapeutic Agents INHIBOX LTD. (GB) 2010-12-09 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-20100311741-A1 Bicyclosulfonyl Acid (BCSA) Compounds and Their Use as Therapeutic Agents TNF, CS, COASY GABRA1 692/4885GABRB2 507/4885ALDH1A1 1941/4885

“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.