SCHEMBL19699375

SCHEMBL19699375

CC(=O)c1c(-c2c(Cl)cncc2Cl)noc1C1CC1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 18/20 0.47
GPBAR1 Q8TDU6 1/20 0.42
RET P07949 1/20 0.42

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
SCHEMBL2003343 0.88 NR1H4 (0.48) NR1H4
SCHEMBL22397165 0.86 POLB (0.50) NR1H4
SCHEMBL2003480 0.83 NR1H4 (0.45) NR1H4
SCHEMBL2003625 0.83 NR1H4 (0.44) NR1H4
SCHEMBL12878991 0.79 NR1H4 (0.43) NR1H4
SCHEMBL1999960 0.78 NR1H4 (0.42) NR1H4
SCHEMBL20952007 0.76 NR1H4 (0.41) NR1H4
SCHEMBL21326421 0.75 NR1H4 (0.48) NR1H4
SCHEMBL12168753 0.75 NR1H4 (0.46) NR1H4
SCHEMBL12168769 0.75 NR1H4 (0.43) NR1H4

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-20170355693-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 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-20170355693-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 NR1H4 1/4885GPBAR1 5/4885RET 446/4885

“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.