SCHEMBL30468036

SCHEMBL30468036

N#Cc1ccc(OC2CC2)c(-c2cnc(C(=O)N[C@@H]3C[C@H](CF)N(C#N)C3)o2)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DGAT2 Q96PD7 1/20 0.37
▸ GPR6 P46095 12/20 0.36
▸ PRKAA2 P54646 5/20 0.35
▸ PRKAB2 O43741 2/20 0.35
▸ PRKAG1 P54619 2/20 0.35
▸ PRKAA1 Q13131 2/20 0.35
▸ PRKAG3 Q9UGI9 2/20 0.35
▸ PRKAG2 Q9UGJ0 2/20 0.35
▸ PRKAB1 Q9Y478 2/20 0.35
▸ USP30 Q70CQ3 1/20 0.34
▸ AR P10275 1/20 0.34

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
SCHEMBL30468018 1.00 DGAT2 (0.37) DGAT2GPR6PRKAA2PRKAB2PRKAG1
SCHEMBL26388448 0.92 DGAT2 (0.39) DGAT2GPR6PRKAA2
SCHEMBL30467995 0.92 DGAT2 (0.39) DGAT2GPR6PRKAA2
SCHEMBL30467952 0.89 DGAT2 (0.38) DGAT2GPR6PRKAA2USP30AR
SCHEMBL30468000 0.89 DGAT2 (0.38) DGAT2GPR6PRKAA2USP30AR
SCHEMBL30468015 0.86 IRAK4 (0.36) DGAT2GPR6
SCHEMBL25837892 0.84 USP30 (0.34) DGAT2GPR6PRKAA2USP30AR
SCHEMBL30467966 0.83 HDAC1 (0.38) USP30
SCHEMBL30468009 0.83 HDAC1 (0.38) USP30
SCHEMBL30468069 0.83 TBK1 (0.36) DGAT2GPR6PRKAA2PRKAB2PRKAG1

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
EP-4161920-A1 N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2023-04-12 — — EP claimed
EP-4161920-A1 N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2023-04-12 — — EP disclosed
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