SCHEMBL29467359

SCHEMBL29467359

Clc1cccc(Cl)c1-c1noc(C2CC2)c1COc1ccc2cc(Br)ccc2n1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 20/20 0.53
FABP1 P07148 1/20 0.51

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
SCHEMBL28728433 1.00 NR1H4 (0.53) NR1H4FABP1
SCHEMBL24313837 0.84 NR1H4 (0.55) NR1H4FABP1
SCHEMBL29726979 0.81 NR1H4 (0.55) NR1H4FABP1
SCHEMBL23474148 0.81 NR1H4 (0.55) NR1H4FABP1
SCHEMBL24585140 0.78 NR1H4 (0.56) NR1H4FABP1
SCHEMBL4283066 0.78 NR1H4 (0.56) NR1H4FABP1
SCHEMBL29904900 0.77 NR1H4 (0.64) NR1H4
SCHEMBL20419411 0.77 NR1H4 (0.64) NR1H4
SCHEMBL12168807 0.77 NR1H4 (0.66) NR1H4FABP1
SCHEMBL25665568 0.77 NR1H4 (0.60) NR1H4FABP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315815-B Compounds for modulating FXR activity and uses thereof 甘莱制药有限公司 2024-07-19 CN disclosed
WO-2022077161-A1 COMPOUNDS FOR MODULATING ACTIVITY OF FXR AND USES THEREOF GANNEX PHARMA CO., LTD. (CN) 2022-04-21 WO disclosed
CN-114315815-A Compounds for modulating FXR activity and uses thereof 甘莱制药有限公司 2022-04-12 CN disclosed