SCHEMBL29436705

SCHEMBL29436705

O=S1(=O)OC(c2ccc(O)c(O)c2)(c2ccc(O)c(O)c2)c2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.70
LMNA P02545 3/20 0.70
KMT2A Q03164 3/20 0.70
CYP1A2 P05177 1/20 0.70
CYP2C9 P11712 1/20 0.70
HIF1A Q16665 1/20 0.70
TDP1 Q9NUW8 3/20 0.58
PTPN11 Q06124 2/20 0.58
ALDH1A1 P00352 2/20 0.58
CYP3A4 P08684 2/20 0.58
MAPK1 P28482 1/20 0.58
CDK2 P24941 1/20 0.52
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
DHFR P00374 5/20 0.33
TYMS P04818 4/20 0.33
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 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
SCHEMBL152384 1.00 MEN1 (0.70) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL63456 0.87 TDP1 (0.69) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL30823023 0.87 MEN1 (0.65) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL29359581 0.87 MEN1 (0.65) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL4949654 0.87 MEN1 (0.65) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL1554463 0.87 TDP1 (0.69) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL14905229 0.87 MEN1 (0.65) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL29390175 0.87 TDP1 (0.69) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL16303141 0.87 MEN1 (0.65) MEN1LMNAKMT2ACYP1A2CYP2C9
SCHEMBL30823024 0.87 MEN1 (0.65) MEN1LMNAKMT2ACYP1A2CYP2C9

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-11236234-B2 Joint compounds and plasters with a complexometric dye and methods UNITED STATES GYPSUM COMPANY (US) 2022-02-01 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-11236234-B2 Joint compounds and plasters with a complexometric dye and methods LCP1, INTS6, PLOD2 MEN1 888/4885LMNA 2490/4885KMT2A 451/4885

“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.