SCHEMBL19194335

SCHEMBL19194335

COc1cncc(Oc2ccc(S(=O)(=O)C(F)(F)F)c3c2CC[C@@H]3O)c1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 16/20 0.80
▸ VEGFA P15692 5/20 0.68

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
SCHEMBL30856882 1.00 EPAS1 (0.80) EPAS1VEGFA
SCHEMBL18036965 1.00 EPAS1 (0.80) EPAS1VEGFA
SCHEMBL18036711 0.89 EPAS1 (1.00) EPAS1VEGFA
SCHEMBL18036788 0.85 EPAS1 (1.00) EPAS1VEGFA
SCHEMBL19870770 0.83 EPAS1 (0.69) EPAS1VEGFA
SCHEMBL16560833 0.81 VEGFA (1.00) EPAS1VEGFA
SCHEMBL18036839 0.81 EPAS1 (0.69) EPAS1VEGFA
SCHEMBL30856846 0.81 EPAS1 (0.69) EPAS1VEGFA
SCHEMBL16555876 0.80 EPAS1 (1.00) EPAS1VEGFA
SCHEMBL16560802 0.79 EPAS1 (1.00) EPAS1VEGFA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9969689-B2 Aryl ethers and uses thereof PELOTON THERAPEUTICS, INC. (US) 2018-05-15 — — US disclosed
US-9969689-B2 Aryl ethers and uses thereof PELOTON THERAPEUTICS, INC. (US) 2018-05-15 — — US disclosed
US-20170217891-A1 ARYL ETHERS AND USES THEREOF PELOTON THERAPEUTICS, INC. 2017-08-03 — — US disclosed
US-20170217891-A1 ARYL ETHERS AND USES THEREOF PELOTON THERAPEUTICS, INC. 2017-08-03 — — 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-20170217891-A1 ARYL ETHERS AND USES THEREOF HIF1AN, EGLN2, VHL EPAS1 9/4885VEGFA 21/4885

“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.

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