SCHEMBL21574296

SCHEMBL21574296

CC(C)NC(=O)NCCN(CC1=CC=CCC1F)C(=O)c1nn(C)c2c1COc1ccc(Cl)cc1-2

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 18/20 0.59

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
SCHEMBL18191578 0.84 NR1H4 (0.69) NR1H4
SCHEMBL18191584 0.76 NR1H4 (0.84) NR1H4
SCHEMBL18191614 0.76 NR1H4 (0.72) NR1H4
SCHEMBL18191646 0.75 NR1H4 (1.00) NR1H4
SCHEMBL21574214 0.74 NR1H4 (0.55) NR1H4
SCHEMBL18191613 0.74 NR1H4 (0.68) NR1H4
SCHEMBL21574198 0.73 NR1H4 (0.58) NR1H4
SCHEMBL18191644 0.73 NR1H4 (0.60) NR1H4
SCHEMBL18191647 0.72 NR1H4 (0.57) NR1H4
SCHEMBL18191577 0.72 NR1H4 (0.57) 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
EP-3288948-B1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2019-11-20 — — EP disclosed
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