SCHEMBL31215036

SCHEMBL31215036

Nc1cc(-c2ccc(I)cn2)no1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ IDO1 P14902 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
SCHEMBL16826030 0.79 KDM4E (0.42) KDM4EALDH1A1MAPTBLMIDO1
SCHEMBL13662717 0.79 CCR1 (0.57) KDM4EALDH1A1MAPTBLM
SCHEMBL4390590 0.76 CCR1 (0.46) KDM4EALDH1A1BLM
SCHEMBL31215055 0.76 KDM4E (0.46) KDM4EALDH1A1MAPTBLM
SCHEMBL13659749 0.75 ALDH1A1 (0.39) KDM4EALDH1A1MAPTBLM
SCHEMBL22926102 0.75 NPSR1 (0.42) KDM4EALDH1A1MAPTBLM
SCHEMBL23504950 0.66 CYP11B1 (0.43) KDM4EALDH1A1MAPTBLM
SCHEMBL20371178 0.65 CCR1 (0.36) —
SCHEMBL16847996 0.64 MAPT (0.46) KDM4EALDH1A1MAPTBLM
SCHEMBL20390109 0.63 ADORA3 (0.44) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4713306-A1 NOVEL TRACER FOR THE IN VIVO DETECTION OF THE AGGREGATION OF ALPHA-SYNUCLEIN Stichting Amsterdam UMC (NL) 2026-03-25 — — EP disclosed
WO-2024236054-A1 NOVEL TRACER FOR THE IN VIVO DETECTION OF THE AGGREGATION OF ALPHA-SYNUCLEIN Stichting Amsterdam UMC (NL) 2024-11-21 — — WO disclosed
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