SCHEMBL31703309

SCHEMBL31703309

O=C(Cn1nc(-c2ccccc2)ccc1=O)Nc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.74
▸ KDM4E B2RXH2 3/20 0.74
▸ MEN1 O00255 2/20 0.74
▸ KMT2A Q03164 2/20 0.74
▸ ADRB2 P07550 1/20 0.74
▸ PKM P14618 1/20 0.74
▸ TSHR P16473 2/20 0.70
▸ HTT P42858 2/20 0.70
▸ LMNA P02545 3/20 0.70
▸ SMN1; SMN2 Q16637 2/20 0.66
▸ USP2 O75604 1/20 0.66
▸ MAPT P10636 5/20 0.62

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
SCHEMBL31703255 0.92 KDM4E (0.72) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31703482 0.88 KDM4E (0.67) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31703155 0.88 MAPT (0.77) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31703498 0.87 ACHE (0.67) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31703451 0.85 ACHE (0.68) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31703313 0.85 KDM4E (0.66) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31703490 0.85 KDM4E (0.66) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL23202557 0.84 KDM4E (0.69) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL31096525 0.84 KDM4E (0.69) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL5579936 0.84 HTT (0.69) ALDH1A1KDM4EMEN1KMT2AADRB2

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-2025215121-A1 HEDGEHOG ACYLTRANSFERASE INHIBITORS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2025-10-16 — — WO disclosed
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