SCHEMBL16347646

SCHEMBL16347646

Cc1cc(OCCCS(C)(=O)=O)c2c(c1-c1cccc(COc3ccc4c(c3)OC[C@H]4CC(=O)O)c1)CC2

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.81
GNA15 P30679 1/20 0.81
SLC10A1 Q14973 1/20 0.81
ABCC2 Q92887 1/20 0.81
SLCO1B3 Q9NPD5 1/20 0.81
SLCO1B1 Q9Y6L6 1/20 0.81

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
SCHEMBL16347531 1.00 FFAR1 (0.81) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL16388685 0.94 FFAR1 (0.71) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL16388358 0.93 FFAR1 (0.70) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL16388392 0.93 FFAR1 (0.70) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL16347718 0.90 FFAR1 (0.75) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL16347720 0.90 FFAR1 (0.75) FFAR1GNA15SLC10A1ABCC2SLCO1B3
Fasiglifam SCHEMBL16448782 0.90 FFAR1 (1.00) FFAR1GNA15SLC10A1ABCC2SLCO1B3
Fasiglifam SCHEMBL31192643 0.90 FFAR1 (1.00) FFAR1GNA15SLC10A1ABCC2SLCO1B3
Fasiglifam SCHEMBL16448793 0.90 FFAR1 (1.00) FFAR1GNA15SLC10A1ABCC2SLCO1B3
Fasiglifam SCHEMBL29360096 0.90 FFAR1 (1.00) FFAR1GNA15SLC10A1ABCC2SLCO1B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104507921-B Benzocyclobutene derivative and preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2017-02-22 CN disclosed
CN-104507921-A Benzocyclobutene derivative and preparation method and pharmaceutical application thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2015-04-08 CN disclosed
WO-2015000412-A1 BENZOCYCLOBUTENE DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 (CN) 2015-01-08 WO disclosed
WO-2015000412-A1 BENZOCYCLOBUTENE DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 (CN) 2015-01-08 WO disclosed