SCHEMBL31459366

SCHEMBL31459366

CCOC(=O)c1cc(C(F)F)n(CCC(N)=O)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NR1H2 P55055 2/20 0.38
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.37
CA9 Q16790 1/20 0.36
CYP1A2 P05177 1/20 0.36
MAPT P10636 3/20 0.36
THRB P10828 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL31459316 0.85 GAA (0.42) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL31459144 0.83 MEN1 (0.35) KMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL31459441 0.82 GAA (0.39) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL31459254 0.82 GAA (0.48) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL31459088 0.81 NR1H2 (0.41) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL16344084 0.80 GAA (0.43) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL31459409 0.79 GAA (0.46) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL31459416 0.79 ALDH1A1 (0.41) ALDH1A1GAAHPGDKDM4EKMT2A
SCHEMBL31459442 0.78 ALDH1A1 (0.53) ALDH1A1GAAHPGDKDM4EHSD17B10
SCHEMBL31459552 0.76 GAA (0.41) ALDH1A1GAAHPGDKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025096660-A1 COMPOSITIONS AND INHIBITORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
WO-2025096658-A1 COMPOSITIONS AND INHIBITORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
WO-2025096654-A1 COMPOSITIONS AND INHIBITORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
WO-2025096662-A1 COMPOSITIONS AND INHIBITORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
WO-2025096657-A1 COMPOSITIONS AND INHIBITORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
WO-2025096653-A1 COMPOSITIONS AND INHIBITORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed