SCHEMBL31554720

SCHEMBL31554720

CC(C(=O)O)c1nn(C)c2c([N+](=O)[O-])cccc12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.39
▸ FBP1 P09467 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ GPR35 Q9HC97 1/20 0.37
▸ DNA2 P51530 1/20 0.37
▸ CASP6 P55212 1/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SSTR4 P31391 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ FGFR1 P11362 1/20 0.36

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
SCHEMBL31554609 0.86 ALDH1A1 (0.46) TDP1LMNASMN1; SMN2GAATSHR
SCHEMBL31554646 0.82 TDP1 (0.39) TDP1FBP1LMNASMN1; SMN2GAA
SCHEMBL13106231 0.75 TDP1 (0.48) TDP1SMN1; SMN2GAATSHRL3MBTL1
SCHEMBL31330879 0.74 TDP1 (0.47) TDP1SMN1; SMN2GAATSHRL3MBTL1
SCHEMBL31554686 0.74 GAA (0.48) TDP1SMN1; SMN2GAATSHRL3MBTL1
SCHEMBL25270235 0.74 TDP1 (0.47) TDP1SMN1; SMN2GAATSHRL3MBTL1
SCHEMBL31230971 0.74 TDP1 (0.47) TDP1SMN1; SMN2GAATSHRL3MBTL1
SCHEMBL31554591 0.72 TDP1 (0.42) TDP1SMN1; SMN2GAAL3MBTL1POLB
SCHEMBL31554652 0.72 L3MBTL1 (0.47) TDP1LMNAL3MBTL1MEN1KMT2A
SCHEMBL13106351 0.71 TDP1 (0.44) TDP1FBP1SMN1; SMN2GAATSHR

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-2025096706-A1 MODULATORS OF BCL6 AS LIGAND DIRECTED DEGRADERS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-08 — — WO disclosed
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