SCHEMBL20047702

SCHEMBL20047702

CC(C)c1ccc2nc(C(C)(C)C)ccc2c1F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EIF4A3 P38919 1/20 0.33
CCR4 P51679 1/20 0.32
HMGCR P04035 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL13666881 0.80 CYP11B2 (0.32) MAPT
SCHEMBL20049314 0.78 EIF4A3 (0.36) EIF4A3
SCHEMBL21098313 0.78 ALDH1A1 (0.39) EIF4A3
SCHEMBL13666781 0.78 ALDH1A1 (0.36) MAPT
SCHEMBL20043185 0.78 ALOX5AP (0.31)
SCHEMBL20047599 0.77 CCR4 (0.39) CCR4HMGCR
SCHEMBL20047696 0.74 CCNT1 (0.34) EIF4A3CCR4
SCHEMBL20386072 0.71 CCR4 (0.38) CCR4
SCHEMBL26510113 0.71 CCR4 (0.38) CCR4
SCHEMBL20047703 0.70

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-10450306-B2 Isoxazole analogs as FXR agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2019-10-22 US disclosed
US-20180099957-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2018-04-12 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-10450306-B2 Isoxazole analogs as FXR agonists and methods of use thereof GPBAR1, SLC10A1, NR1H4 EIF4A3 1769/4885CCR4 1960/4885HMGCR 276/4885
US-20180099957-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF GPBAR1, SLC10A1, NR1H4 EIF4A3 1769/4885CCR4 1960/4885HMGCR 276/4885

“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.