SCHEMBL22320341

SCHEMBL22320341

CC(C)(C)[Si](C)(C)Oc1ccc(C2(O)CN(C(=O)O)C2)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.39
CA1 P00915 4/20 0.39
CA9 Q16790 4/20 0.39
PREP P48147 2/20 0.36
NR1H4 Q96RI1 13/20 0.35
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
HSD17B13 Q7Z5P4 1/20 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
SCHEMBL19689482 0.88 MET (0.37) CA12CA1CA9PREP
SCHEMBL29736070 0.88 MET (0.37) CA12CA1CA9PREP
SCHEMBL19698945 0.80 CA12 (0.38) CA12CA1CA9PREPHSP90AA1
SCHEMBL29216000 0.80 NR1H4 (0.54) NR1H4HSD17B13
SCHEMBL30775154 0.80 NR1H4 (0.54) NR1H4HSD17B13
SCHEMBL30775155 0.79 CA12 (0.37) CA12CA1CA9PREPHSP90AA1
SCHEMBL19689521 0.79 CA12 (0.37) CA12CA1CA9PREPHSP90AA1
Hydrochloric Acid SCHEMBL29489583 0.78 CA12 (0.36) CA12CA1CA9PREPHSP90AA1
Hydrochloric Acid SCHEMBL19690213 0.78 CA12 (0.36) CA12CA1CA9PREPHSP90AA1
SCHEMBL29139869 0.77 NR1H4 (0.45) CA12CA1CA9NR1H4HSD17B13

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-11225473-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2022-01-18 US disclosed
US-20200255418-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2020-08-13 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-11225473-B2 FXR (NR1H4) modulating compounds NR1H4, NR1H2, NR1H3 CA12 4742/4885CA1 4536/4885CA9 4854/4885
US-20200255418-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 CA12 4742/4885CA1 4536/4885CA9 4854/4885

“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.