SCHEMBL19910347

SCHEMBL19910347

Cn1nc(C(=O)N(CC(=O)NC2=CC(C(=O)O)=CCC2F)Cc2ccccc2)c2c1-c1cc(F)ccc1OC2

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 18/20 0.64
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL16702262 0.82 NR1H4 (0.92) NR1H4POLBMAPT
SCHEMBL19910458 0.80 NR1H4 (0.66) NR1H4
SCHEMBL18994755 0.79 NR1H4 (0.81) NR1H4POLBMAPT
SCHEMBL16709824 0.79 NR1H4 (0.66) NR1H4
SCHEMBL16701975 0.78 NR1H4 (1.00) NR1H4POLBMAPT
SCHEMBL18993366 0.77 NR1H4 (0.72) NR1H4POLBMAPT
SCHEMBL19910404 0.77 NR1H4 (0.57) NR1H4MAPT
SCHEMBL16701915 0.77 NR1H4 (0.91) NR1H4POLBMAPT
SCHEMBL18993364 0.76 NR1H4 (0.81) NR1H4POLBMAPT
SCHEMBL16702273 0.76 NR1H4 (0.80) NR1H4POLBMAPT

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
EP-3065738-B1 COMPOSITIONS AND METHODS FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2018-02-28 — — EP disclosed
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