SCHEMBL31389883

SCHEMBL31389883

Cc1c(F)cc(Br)c(NC(N)=S)c1Br

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP1A2 P05177 1/20 0.34
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ AKT1 P31749 1/20 0.30
▸ CTSL P07711 1/20 0.30

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
SCHEMBL1192648 0.74 GAA (0.67) KMT2AMAPTGAAL3MBTL1ALDH1A1
SCHEMBL23250446 0.74 CYP3A4 (0.34) HDAC1HDAC6
SCHEMBL5450263 0.70 GAA (0.46) KMT2AMAPTGAAL3MBTL1CYP1A2
SCHEMBL13846512 0.69 GAA (0.44) KMT2AMAPTGAAL3MBTL1CYP1A2
SCHEMBL31389820 0.68 ALDH1A1 (0.38) MAPTL3MBTL1CYP1A2ALDH1A1HTT
SCHEMBL16451221 0.68 HDAC1 (0.33) KMT2AHDAC1HDAC6
SCHEMBL18550697 0.67 L3MBTL1 (0.40) KMT2AMAPTGAAL3MBTL1CYP1A2
SCHEMBL11918917 0.67 ALDH1A1 (0.56) KMT2AMAPTL3MBTL1CYP1A2ALDH1A1
SCHEMBL23813836 0.67 HDAC1 (0.35) CYP1A2HDAC1HDAC6
SCHEMBL10911325 0.67 L3MBTL1 (0.52) KMT2AMAPTGAAL3MBTL1CYP1A2

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-2025043225-A2 DEGRADERS OF CYCLIN-DEPENDENT KINASE 2 GENENTECH, INC. (US) 2025-02-27 — — WO disclosed
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