SCHEMBL25836502

SCHEMBL25836502

COC(OC)c1cc(I)cc(I)c1O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.56
GABRA1 P14867 1/20 0.47
GABRB1 P18505 1/20 0.47
GABRB2 P47870 1/20 0.47
ERN1 O75460 1/20 0.38
ALB P02768 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 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
SCHEMBL22991642 0.82 TTR (0.54) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL7927726 0.77 GABRA1 (0.78) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL25836512 0.76 TTR (0.34) TTRGABRA1GABRB1GABRB2
SCHEMBL22991569 0.75 TTR (0.61) TTRGABRA1GABRB1GABRB2ERN1
Triiodophenol SCHEMBL338137 0.75 TTR (1.00) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL21159415 0.74 TTR (0.59) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL26696417 0.73 TTR (0.58) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL10877649 0.72 TTR (0.56) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL26295914 0.71 TTR (0.54) TTRGABRA1GABRB1GABRB2ERN1
SCHEMBL29228155 0.70 CA1 (0.36) GABRA1GABRB1GABRB2CYP1A2HIF1A

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-20230279172-A1 RADIOPAQUE POLYMERS Boston Scientific Medical Device Limited (IE) 2023-09-07 US disclosed
US-11702498-B2 Radiopaque polymers BIOCOMPATIBLES UK LIMITED 2023-07-18 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 (2 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-20230279172-A1 RADIOPAQUE POLYMERS SSTR3, VHL, PLG TTR 1841/4885GABRA1 1869/4885GABRB1 2722/4885
US-11702498-B2 Radiopaque polymers OXER1, NR5A1, AQP1 TTR 3572/4885GABRA1 1985/4885GABRB1 2306/4885

“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.