SCHEMBL7255131

SCHEMBL7255131

CCOC(=O)C(OCC)C(I)c1ccc(O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.45
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA7 P43166 4/20 0.45
CA9 Q16790 4/20 0.45
CA14 Q9ULX7 4/20 0.45
ESR1 P03372 4/20 0.45
ESR2 Q92731 3/20 0.45
PTGS2 P35354 3/20 0.41
KMT2A Q03164 1/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
CHRM1 P11229 2/20 0.38
SLC6A2 P23975 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP1A2 P05177 1/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADORA3 P0DMS8 1/20 0.38

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
SCHEMBL3233309 0.83 ESR1 (0.46) CA12CA1CA2CA7CA9
SCHEMBL4744499 0.83 ESR1 (0.46) CA12CA1CA2CA7CA9
SCHEMBL14763374 0.77 ESR1 (0.50) CA12CA1CA2CA7CA9
SCHEMBL1395571 0.74 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL1043357 0.74 ESR1 (0.55) CA12CA1CA2CA7CA9
SCHEMBL5209871 0.73 ESR1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL5209865 0.73 ESR1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL1792502 0.73 ESR1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL9235662 0.73 ESR1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL9232941 0.73 ESR1 (0.53) CA12CA1CA2CA7CA9

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-20030125553-A1 Process for the preparation of new antidiabetic agents DR. REDDY'S LABORATORIES LIMITED 2003-07-03 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-20030125553-A1 Process for the preparation of new antidiabetic agents GLP1R, GPR119, SLC5A1 CA12 3451/4885CA1 3473/4885CA2 2615/4885

“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.