SCHEMBL21574259

SCHEMBL21574259

Cn1nc(C(=O)N(Cc2ccccc2)CC2C=C(F)C=CC2)c2c1-c1cc(Cl)ccc1OC2

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 18/20 0.67
▸ 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
SCHEMBL18191592 0.82 NR1H4 (0.79) NR1H4POLBMAPT
SCHEMBL16709828 0.81 NR1H4 (0.80) NR1H4POLBMAPT
Nidufexor SCHEMBL16702097 0.81 NR1H4 (1.00) NR1H4POLBMAPT
Nidufexor SCHEMBL29416457 0.81 NR1H4 (1.00) NR1H4POLBMAPT
SCHEMBL18191637 0.81 NR1H4 (0.84) NR1H4POLBMAPT
SCHEMBL16702670 0.80 NR1H4 (0.81) NR1H4POLBMAPT
SCHEMBL19910435 0.80 NR1H4 (0.48) NR1H4POLBMAPT
SCHEMBL16702185 0.79 NR1H4 (0.87) NR1H4POLBMAPT
SCHEMBL18191619 0.79 NR1H4 (0.81) NR1H4POLBMAPT
SCHEMBL18191668 0.79 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-3288948-B1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2019-11-20 — — EP disclosed
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