SCHEMBL28293042

SCHEMBL28293042

FC(F)(F)c1ccnc(I)c1Br

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31

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
SCHEMBL30080446 0.79
SCHEMBL7259602 0.78 NOS3 (0.33) NOS3NOS2
SCHEMBL21092870 0.75 S1PR1 (0.33) NOS3NOS2
SCHEMBL30510498 0.75 S1PR1 (0.33) NOS3NOS2
SCHEMBL30401019 0.75 NOS3 (0.39) NOS3NOS2
SCHEMBL21598657 0.75 KMO (0.35) NOS3NOS2
SCHEMBL25260810 0.71
SCHEMBL5942420 0.71 SLC22A12 (0.40)
SCHEMBL30079551 0.71 SLC22A12 (0.40)
SCHEMBL25299262 0.71 TDO2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109867630-A - 1 receptor modulators of novel glp-1 赛尔基因第二国际有限公司 2019-06-11 CN disclosed
CN-105593225-B novel GLP-1 receptor modulators 赛尔基因第二国际有限公司 2019-04-16 CN disclosed