SCHEMBL30952676

SCHEMBL30952676

Cc1ccc(N2CC3CN(C(=O)OC(C)(C)C)CC3C2)cc1C(=O)NC(C)c1cc(Br)cc(Br)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.39
GPR119 Q8TDV5 3/20 0.37
LMNA P02545 1/20 0.36
ACACB O00763 5/20 0.36
RORC P51449 2/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 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
SCHEMBL30952660 0.88 LMNA (0.44) GPR119LMNACYP2C19
SCHEMBL30083233 0.85 SMN1; SMN2 (0.44) ACACB
SCHEMBL30083142 0.80 BACE1 (0.45) GPR119LMNACYP2C19
SCHEMBL31218062 0.79 ACACB (0.39) ACACB
SCHEMBL24732366 0.79 ACACB (0.39) ACACB
SCHEMBL30952684 0.79 GPR119 (0.45) USP30GPR119HDAC1HDAC2
SCHEMBL30837378 0.78 GPR119 (0.46) GPR119LMNAHDAC1HDAC2
SCHEMBL29181034 0.78 GPR119 (0.46) GPR119LMNAHDAC1HDAC2
SCHEMBL30952659 0.77 RET (0.45) GPR119
SCHEMBL30952662 0.77 RET (0.45) GPR119

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-2024121709-A1 PAPAIN-LIKE PROTEASE (PLPRO) INHIBITORS PFIZER INC. (US) 2024-06-13 WO disclosed