SCHEMBL28027434

SCHEMBL28027434

Cc1cc2c(c(C)c1-c1cccc(COC3CCCCO3)c1)C(NCC(C)S(C)(=O)=O)CO2

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.33
GNA15 P30679 1/20 0.33
SLC10A1 Q14973 1/20 0.33
ABCC2 Q92887 1/20 0.33
SLCO1B3 Q9NPD5 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33

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
SCHEMBL28027429 0.87 FFAR1 (0.41) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL28027952 0.80 FFAR1 (0.36) FFAR1
SCHEMBL28027971 0.74 FFAR1 (0.35) FFAR1
SCHEMBL5102053 0.71 FFAR1 (0.40) FFAR1
SCHEMBL28027395 0.68 FFAR1 (0.43) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL5115209 0.67 FFAR1 (0.51) FFAR1
SCHEMBL92954 0.65 NAAA (0.47)
SCHEMBL5102120 0.64 FFAR1 (0.53) FFAR1
SCHEMBL23662561 0.64 CREBBP (0.38)
SCHEMBL92943 0.62 KDM4C (0.41)

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
CN-104870429-A Benzofuran derivative, preparation method therefor, and medical application thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2015-08-26 CN disclosed