SCHEMBL22705335

SCHEMBL22705335

C=CCC(C)OCc1c(-c2c(Cl)cc(F)cc2Cl)noc1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 20/20 0.43
FABP1 P07148 2/20 0.41
HSD17B13 Q7Z5P4 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
SCHEMBL19705737 0.86 NR1H4 (0.47) NR1H4FABP1HSD17B13
SCHEMBL24565512 0.84 NR1H4 (0.46) NR1H4FABP1HSD17B13
SCHEMBL19689533 0.75 NR1H4 (0.44) NR1H4FABP1HSD17B13
SCHEMBL28320904 0.74 NR1H4 (0.46) NR1H4FABP1HSD17B13
SCHEMBL19689512 0.74 NR1H4 (0.46) NR1H4FABP1HSD17B13
SCHEMBL28870286 0.72 NR1H4 (0.43) NR1H4FABP1HSD17B13
SCHEMBL29662860 0.71 NR1H4 (0.46) NR1H4
SCHEMBL19689496 0.71 NR1H4 (0.57) NR1H4FABP1HSD17B13
SCHEMBL20859034 0.69 NR1H4 (0.55) NR1H4FABP1HSD17B13
SCHEMBL20094441 0.69 NR1H4 (0.60) NR1H4FABP1HSD17B13

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-20200369632-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2020-11-26 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-20200369632-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 NR1H4 1/4885FABP1 15/4885HSD17B13 681/4885

“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.