SCHEMBL30592053

SCHEMBL30592053

NC(=O)C1CC(n2nc3ccccn3c2=O)CN1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GPR139 Q6DWJ6 6/20 0.33
▸ LMNA P02545 1/20 0.33
▸ KCNH2 Q12809 4/20 0.32
▸ SCN5A Q14524 4/20 0.32
▸ HTRA1 Q92743 1/20 0.32
▸ DPP8 Q6V1X1 1/20 0.32
▸ DPP9 Q86TI2 1/20 0.32
▸ DPP7 Q9UHL4 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ MMP3 P08254 1/20 0.31
▸ MMP9 P14780 1/20 0.31
▸ MMP13 P45452 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
SCHEMBL30592225 0.73 DPP4 (0.38) DPP8DPP9DPP7DPP4
SCHEMBL30592083 0.71 DPP4 (0.37) KCNH2DPP8DPP9DPP7DPP4
SCHEMBL30592331 0.70 CHRNB2 (0.32) DPP4
SCHEMBL24819773 0.69 KCNH2 (0.39) GPR139KCNH2SCN5AIRAK4
SCHEMBL30592208 0.69 L3MBTL1 (0.40) LMNADPP8DPP9DPP7DPP4
SCHEMBL24820619 0.69 KCNH2 (0.38) GPR139KCNH2SCN5AIRAK4
SCHEMBL8383259 0.63 GPR139 (0.40) GPR139PTGS1PTGS2
SCHEMBL21477243 0.63 CRBN (0.51) —
SCHEMBL30918644 0.60 HDAC2 (0.61) DPP4
SCHEMBL29062785 0.60 HDAC2 (0.61) DPP4

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
EP-3472149-B1 HETEROCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2023-08-30 — — EP claimed
Send feedback