SCHEMBL7596897

SCHEMBL7596897

O=C(O)c1c(I)c(I)c(C(=O)O)c(I)c1I

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 2/20 0.41
CYP1A2 P05177 2/20 0.40
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 2/20 0.33
MAPK1 P28482 1/20 0.33
DPP4 P27487 1/20 0.32
TP53 P04637 1/20 0.32
NOTUM Q6P988 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL1859003 0.96 TPMT (0.39) TPMTCYP1A2CA12CA1CA2
SCHEMBL9600105 0.96 TPMT (0.39) TPMTCYP1A2CA12CA1CA2
SCHEMBL8855992 0.96 TPMT (0.39) TPMTCYP1A2CA12CA1CA2
Hydrochloric Acid SCHEMBL8541347 0.96 TPMT (0.39) TPMTCYP1A2CA12CA1CA2
Hydrochloric Acid SCHEMBL8824728 0.93 TPMT (0.38) TPMTCYP1A2CA12CA1CA2
SCHEMBL8537633 0.93 TPMT (0.38) TPMTCYP1A2CA12CA1CA2
SCHEMBL4587818 0.92 TPMT (0.41) TPMTCYP1A2CA12CA1CA2
Hydrochloric Acid SCHEMBL8536294 0.90 TPMT (0.36) TPMTCYP1A2CA12CA1CA2
Hydrochloric Acid SCHEMBL9787611 0.89 TPMT (0.39) TPMTCYP1A2CA12CA1CA2
SCHEMBL4265757 0.89 TPMT (0.39) TPMTCYP1A2CA12CA1CA2

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 103 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118684589-A Preparation method of iodine-containing polyol 宁波贝昂生物材料有限公司 2024-09-24 CN claimed
CN-117887086-A Application of halogen functionalized metal organic framework material in storage and delivery of fluorine-containing electron special gas 华为技术有限公司 2024-04-16 CN claimed
WO-2024074141-A1 POROUS MATERIAL AND APPLICATION THEREOF 华为技术有限公司 2024-04-11 WO claimed
CN-116875024-A Hydrogel with X-ray visibility and preparation method and application thereof 赛克赛斯生物科技股份有限公司 2023-10-13 CN claimed
US-10342232-B1 Iodinated polymers for biological agent defeat THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2019-07-09 US claimed
EP-0618189-B1 Iodinated aromatic propanedioates and their use as X-ray contrast agents NANOSYSTEMS LLC (US) 1997-06-04 EP claimed
EP-0767779-A1 ALPHA-(CYCLOALKYL, ARYL AND ARALKYL)SUBSTITUTED POLYIODINATED AROYLOXY COMPOUNDS NanoSystems L.L.C. (US) 1997-04-16 EP claimed
EP-0756497-A1 X-RAY CONTRAST COMPOSITIONS CONTAINING PHARMACEUTICALLY ACCEPTABLE CLAYS NYCOMED IMAGING AS (NO) 1997-02-05 EP claimed
EP-0749414-A1 IODINATED AROYLOXY KETONES NanoSystems L.L.C. (US) 1996-12-27 EP claimed
EP-0746339-A1 X-RAY CONTRAST COMPOSITIONS CONTAINING CELLULOSE DERIVATIVES NYCOMED IMAGING AS (NO) 1996-12-11 EP claimed
US-5330739-A Iodinated benzoyl acetals and ketals for x-ray imaging STERLING WINTHROP INC. (US) 1994-07-19 US claimed
US-5328404-A Contrast agents STERLING WINTHROP INC. (US) 1994-07-12 US claimed
EP-0603917-A1 Iodinated agents and X-ray imaging compositions containing them NanoSystems L.L.C. (US) 1994-06-29 EP claimed
EP-0603922-A1 Iodinated aroyloxy esters and their use as contrast agents in X-ray imaging NanoSystems L.L.C. (US) 1994-06-29 EP claimed
EP-0603923-A1 Iodinated aromatic acid derivatives and their use as contrast agents in X-ray imaging NanoSystems L.L.C. (US) 1994-06-29 EP claimed
EP-0601616-A1 Iodinated aroyloxy carboxamides and contrast agents containing them NanoSystems L.L.C. (US) 1994-06-15 EP claimed
EP-0601617-A1 Iodinated benzoyl acetals and ketals, and contrast agents containing them NanoSystems L.L.C. (US) 1994-06-15 EP claimed
US-5318768-A For gastrointestinal tract; film membrane, cation potentiator, particle surface modifier STERLING WINTHROP INC. (US) 1994-06-07 US claimed
US-5264610-A X-ray contrast agents STERLING WINTHROP INC. (US) 1993-11-23 US claimed
US-5260478-A Contrast agents in x-ray imaging compositions; medical diagnosis STERLING WINTHROP INC. (US) 1993-11-09 US claimed

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-10342232-B1 Iodinated polymers for biological agent defeat TBCA, HSP90AB2P, LRBA TPMT 3983/4885CYP1A2 3562/4885CA12 1031/4885

“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.