SCHEMBL24914562

SCHEMBL24914562

C#CCN(C(=O)c1ccc(F)nc1)c1cccc(C(=O)Nc2c(Br)cc(C(P)(C(F)(F)F)C(F)(F)F)cc2C(F)(F)F)c1F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLQ O75417 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
PTGES O14684 1/20 0.30

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
SCHEMBL24914563 0.91 POLQ (0.31) POLQPTGES
SCHEMBL24914949 0.90 POLQ (0.33) POLQHDAC8
SCHEMBL24914945 0.89 HDAC8 (0.32) POLQHDAC8
SCHEMBL24914856 0.89
SCHEMBL23059630 0.85 GPBAR1 (0.33) POLQPTGES
SCHEMBL24914849 0.83 POLQ (0.34) POLQHDAC8PTGES
SCHEMBL24914497 0.82 POLQ (0.38) POLQHDAC8PTGES
SCHEMBL23059685 0.81 GPBAR1 (0.35) PTGES
SCHEMBL23053049 0.81 GPBAR1 (0.34) HDAC8PTGES
SCHEMBL29431918 0.81 GPBAR1 (0.34) HDAC8PTGES

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
WO-2023284645-A1 AMIDE COMPOUND AND USE THEREOF 沈阳化工大学 2023-01-19 WO disclosed