SCHEMBL1097658

SCHEMBL1097658

O=C(O)[C@H](Cc1ccc(I)cc1)NCc1ccc(I)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.52
FOLH1 Q04609 3/20 0.45
ALDH1A1 P00352 1/20 0.44
ALB P02768 1/20 0.43
IL2 P60568 1/20 0.43
MME P08473 4/20 0.41
PSMB5 P28074 1/20 0.41
MEP1B Q16820 2/20 0.40
ACE P12821 3/20 0.40
CPA1 P15085 2/20 0.40
ACE2 Q9BYF1 2/20 0.40
NAALAD2 Q9Y3Q0 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
SCHEMBL28813427 0.86 FPR2 (0.52) FPR2FOLH1ALBIL2MME
SCHEMBL28813429 0.86 FPR2 (0.52) FPR2FOLH1ALBIL2MME
SCHEMBL148423 0.84 FOLH1 (0.55) FOLH1ALDH1A1MMEACECPA1
SCHEMBL8414223 0.84 FOLH1 (0.55) FOLH1ALDH1A1MMEACECPA1
SCHEMBL497336 0.84 MME (0.56) FOLH1ALDH1A1MMEPSMB5MEP1B
SCHEMBL73955 0.84 MME (0.56) FOLH1ALDH1A1MMEPSMB5MEP1B
SCHEMBL11581853 0.84 MME (0.56) FOLH1ALDH1A1MMEPSMB5MEP1B
SCHEMBL1097668 0.83 FPR2 (0.52) FPR2FOLH1ALDH1A1MMEMEP1B
SCHEMBL1098155 0.83 ALDH1A1 (0.62) FOLH1ALDH1A1MMEACECPA1
SCHEMBL1097115 0.83 ITGB1 (0.51) ALDH1A1MMEPSMB5MEP1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153365-B2 Oligonucleotide analogues EXIQON A/S (DK) 2012-04-10 US disclosed
US-8034909-B2 Oligonucleotide analogues EXIQON A/S (DK) 2011-10-11 US disclosed
US-20110245327-A1 Oligonucleotide Analogues EXIQON A/S (DK) 2011-10-06 US disclosed
EP-2341058-A2 Oligonucleotide Analogues Exiqon A/S (DK) 2011-07-06 EP disclosed
EP-2341057-A2 Oligonucleotide Analogues Exiqon A/S (DK) 2011-07-06 EP 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-20110245327-A1 Oligonucleotide Analogues POLRMT, POLM, POLN FPR2 3091/4885FOLH1 975/4885ALDH1A1 3811/4885

“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.