SCHEMBL30230685

SCHEMBL30230685

O=C(NC1CCN(C(=O)O)C1)c1ncc(-c2cccc(OC(F)(F)F)c2)o1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAP3K7 O43318 1/20 0.42
▸ TAB1 Q15750 1/20 0.42
▸ USP30 Q70CQ3 2/20 0.42
▸ PIM1 P11309 8/20 0.42
▸ HDAC1 Q13547 3/20 0.42
▸ HDAC6 Q9UBN7 3/20 0.42
▸ EGFR P00533 1/20 0.41
▸ BTK Q06187 1/20 0.41
▸ PRKDC P78527 1/20 0.40
▸ MCHR1 Q99705 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4D Q08499 1/20 0.40

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
SCHEMBL30370293 0.86 HDAC1 (0.54) MAP3K7TAB1USP30HDAC1HDAC6
SCHEMBL25676535 0.86 USP30 (0.52) USP30
SCHEMBL25675488 0.81 CA12 (0.49) PIM1HDAC1HDAC6KCNH2
SCHEMBL30230922 0.80 HDAC1 (0.43) PIM1HDAC1HDAC6
SCHEMBL30060169 0.80 HDAC1 (0.43) PIM1HDAC1HDAC6
SCHEMBL25144728 0.79 USP30 (0.42) USP30PIM1HDAC1HDAC6PRKDC
SCHEMBL25144570 0.79 USP30 (0.42) USP30PIM1HDAC1HDAC6PRKDC
Trifluoroacetic Acid SCHEMBL30061795 0.77 HDAC1 (0.42) PIM1HDAC1HDAC6
SCHEMBL27418109 0.77 USP30 (0.56) USP30HDAC1HDAC6
SCHEMBL30060184 0.77 HDAC1 (0.40) USP30PIM1HDAC1HDAC6PRKDC

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-4132925-A1 N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2023-02-15 — — EP disclosed
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