SCHEMBL30801780

SCHEMBL30801780

N#Cc1cccc(-n2cnc(N3CCN4CCNC[C@@H]4C3=O)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.41
DRD2 P14416 4/20 0.41
DRD3 P35462 4/20 0.41
USP30 Q70CQ3 3/20 0.39
ALOX5 P09917 1/20 0.36
NOTUM Q6P988 1/20 0.36
NSD2 O96028 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
FADS1 O60427 2/20 0.35
KCNH2 Q12809 2/20 0.34
DRD4 P21917 2/20 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
SCHEMBL23573995 0.85 USP30 (0.47) GRM5DRD2DRD3USP30ALOX5
SCHEMBL23573993 0.85 USP30 (0.47) GRM5DRD2DRD3USP30ALOX5
SCHEMBL30801717 0.80 NOTUM (0.46) GRM5DRD2DRD3USP30ALOX5
SCHEMBL30801818 0.80 GRM5 (0.43) GRM5DRD2DRD3USP30ALOX5
SCHEMBL30801795 0.80 USP30 (0.43) DRD2DRD3USP30
SCHEMBL30801790 0.80 USP30 (0.43) DRD2DRD3USP30
Hydrochloric Acid SCHEMBL3608093 0.77 DRD2 (0.50) DRD2DRD3ALOX5NOTUMNSD2
SCHEMBL30801797 0.74 GRM5 (0.47) GRM5USP30
SCHEMBL30801856 0.73 USP30 (0.42) DRD2DRD3USP30
SCHEMBL30801732 0.73 USP30 (0.42) DRD2DRD3USP30

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-3793997-B1 FUSED BICYCLIC COMPOUNDS USEFUL AS UBIQUITIN-SPECIFIC PEPTIDASE 30 INHIBITORS FORMA THERAPEUTICS INC (US) 2024-03-13 EP claimed