SCHEMBL31661563

SCHEMBL31661563

Nc1ccc2c(ccn2Cc2ccncc2)c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.54
PLAU P00749 3/20 0.48
PLG P00747 2/20 0.48
PRKCI P41743 1/20 0.45
EGFR P00533 2/20 0.43
ERBB2 P04626 1/20 0.40
MAOB P27338 1/20 0.40
KDM4C Q9H3R0 1/20 0.39
APP P05067 1/20 0.39
NPC1 O15118 1/20 0.39
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL7086252 1.00 HTR6 (0.54) HTR6PLAUPLGPRKCIEGFR
SCHEMBL6355917 0.85 PRKCI (0.46) HTR6PLAUPLGPRKCIEGFR
SCHEMBL2769024 0.84 HTR6 (0.66) HTR6PLAUPLGPRKCIEGFR
SCHEMBL30241534 0.84 HTR6 (0.66) HTR6PLAUPLGPRKCIEGFR
SCHEMBL9198838 0.83 HTR2A (0.51) HTR6PLAUPLGEGFR
SCHEMBL7084091 0.82 PLAU (0.50) HTR6PLAUPLGEGFRKDM4C
SCHEMBL31661458 0.82 PLAU (0.50) HTR6PLAUPLGEGFRKDM4C
SCHEMBL8845761 0.81 HTR6 (0.49) HTR6PLAUPLGMAOBKDM4C
SCHEMBL171614 0.81 SLC6A2 (0.50) HTR6PLAUPLGMAOB
SCHEMBL11959087 0.81 HTR2A (0.51) HTR6PLAUPLGMAOBKDM4C

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-2025151487-A2 SMALL-MOLECULE INHIBITORS OF ADAR1 REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2025-07-17 WO disclosed