SCHEMBL25949015

SCHEMBL25949015

C=C(O)c1ccc(C2CC2)nc1C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
PDE10A Q9Y233 12/20 0.34
GLS O94925 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GAA P10253 1/20 0.32
KDM4E B2RXH2 1/20 0.32
EGFR P00533 1/20 0.31
TEC P42680 1/20 0.31
BTK Q06187 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
SCHEMBL25331964 0.87 POLB (0.45) POLBPDE10AKMT2AMEN1NPC1
SCHEMBL18412836 0.76 TRPV3 (0.39) PDE10A
SCHEMBL15057161 0.75 POLB (0.49) POLBPDE10AKMT2AKDM4E
SCHEMBL18412776 0.72 POLB (0.36) POLBPDE10AGLSKMT2AMEN1
SCHEMBL15058026 0.71 POLB (0.42) POLBPDE10AKMT2AMEN1NPC1
SCHEMBL25332852 0.71 POLB (0.42) POLBPDE10AKMT2AMEN1RAB9A
SCHEMBL25333467 0.71 POLB (0.42) POLBPDE10AKMT2AKDM4E
SCHEMBL24680127 0.70 POLB (0.41) POLBPDE10AKMT2AKDM4E
SCHEMBL21816284 0.70 GABRP (0.53) POLBKMT2AMEN1RAB9AKDM4E
SCHEMBL15058465 0.70 NPSR1 (0.42) POLBPDE10ANPC1RAB9AGAA

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-2023133271-A1 BICYCLIC PHTHALAZIN-1(2H)-ONE DERIVATIVES AND RELATED USES NodThera Limited (GB) 2023-07-13 WO disclosed