SCHEMBL17848927

SCHEMBL17848927

OC1CCC(OCc2c(C3CCC(F)(F)CC3)noc2C2CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 20/20 0.39

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
SCHEMBL28573203 0.85 NR1H4 (0.40) NR1H4
SCHEMBL28915148 0.85 NR1H4 (0.40) NR1H4
SCHEMBL17839766 0.85 NR1H4 (0.39) NR1H4
SCHEMBL17839446 0.85 NR1H4 (0.37) NR1H4
SCHEMBL17839342 0.78 NR1H4 (0.34) NR1H4
SCHEMBL17839466 0.75 NR1H4 (0.32) NR1H4
SCHEMBL17839830 0.74 NR1H4 (0.47) NR1H4
SCHEMBL17856137 0.72 NR1H4 (0.41) NR1H4
SCHEMBL17839571 0.72 NR1H4 (0.41) NR1H4
SCHEMBL17839569 0.72 NR1H4 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233850-A1 HYDROXY CONTAINING FXR (NR1H4) MODULATING COMPOUNDS Gilead Sciences, Inc. (US) 2017-10-25 EP disclosed
WO-2016096115-A1 HYDROXY CONTAINING FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2016-06-23 WO disclosed