SCHEMBL20178620

SCHEMBL20178620

CCCCCc1ccc(C(=O)OC)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.57
RARA P10276 1/20 0.57
RARG P13631 1/20 0.57
PPARA Q07869 2/20 0.55
PPARG P37231 1/20 0.55
KAT8 Q9H7Z6 2/20 0.48
FAAH O00519 1/20 0.46
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44

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
SCHEMBL20476364 0.99 RARB (0.59) RARBRARARARGPPARAPPARG
SCHEMBL7219535 0.89 NPC1 (0.44) RARBRARARARGPPARAPPARG
SCHEMBL20772047 0.88 CYP4A11 (0.59) RARBRARARARGPPARAPPARG
SCHEMBL20772393 0.87 CYP4A11 (0.43) RARBRARARARGPPARAPPARG
SCHEMBL15173816 0.87 KAT8 (0.54) RARBRARARARGPPARAPPARG
SCHEMBL20772389 0.87 CYP4A11 (0.57) RARBRARARARGPPARAPPARG
SCHEMBL20772253 0.87 CYP4A11 (0.58) RARBRARARARGPPARAPPARG
SCHEMBL28773091 0.86 PPARA (0.58) RARBRARARARGPPARAPPARG
SCHEMBL20772052 0.86 RARB (0.45) RARBRARARARGPPARAPPARG
SCHEMBL20772235 0.85 CYP4A11 (0.42) RARBRARARARGPPARAPPARG

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-10597391-B2 Urea-containing isoxazole derivatives as FXR agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2020-03-24 US disclosed
US-20180141941-A1 UREA-CONTAINING ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2018-05-24 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-20180141941-A1 UREA-CONTAINING ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF NR1H4, FXR1, SLC10A1 RARB 877/4885RARA 864/4885RARG 823/4885
US-10597391-B2 Urea-containing isoxazole derivatives as FXR agonists and methods of use thereof NR1H4, FXR1, SLC10A1 RARB 877/4885RARA 864/4885RARG 823/4885

“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.