SCHEMBL29986739

SCHEMBL29986739

O=C(N1Cc2ccc(F)cc2C1)C(F)(F)S(=O)(=O)c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 4/20 0.44
▸ DPP9 Q86TI2 8/20 0.42
▸ DPP4 P27487 6/20 0.42
▸ DPP8 Q6V1X1 6/20 0.42
▸ DPP7 Q9UHL4 5/20 0.42
▸ HSP90B1 P14625 2/20 0.41
▸ TRAP1 Q12931 2/20 0.41
▸ GAA P10253 1/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ TAS1R2 Q8TE23 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ SLC6A9 P48067 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37

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
SCHEMBL24814397 1.00 NAMPT (0.44) NAMPTDPP9DPP4DPP8DPP7
SCHEMBL29987274 0.79 NAMPT (0.46) NAMPTDPP9DPP4DPP8DPP7
SCHEMBL24814393 0.79 NAMPT (0.46) NAMPTDPP9DPP4DPP8DPP7
SCHEMBL24815720 0.77 NAMPT (0.45) NAMPTDPP9DPP4DPP8DPP7
SCHEMBL24814439 0.77 NAMPT (0.46) NAMPTDPP9DPP4DPP8DPP7
SCHEMBL29986479 0.77 NAMPT (0.46) NAMPTDPP9DPP4DPP8DPP7
SCHEMBL29986254 0.72 DPP9 (0.55) DPP9DPP4DPP8DPP7HSP90B1
SCHEMBL24814735 0.72 DPP9 (0.55) DPP9DPP4DPP8DPP7HSP90B1
SCHEMBL24815722 0.70 SMN1; SMN2 (0.38) NAMPTGAALMNA
SCHEMBL8401777 0.70 DPP9 (0.62) NAMPTDPP9DPP4DPP8DPP7

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-2022251343-A2 CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2022-12-01 — — WO disclosed
Send feedback