SCHEMBL31459282

SCHEMBL31459282

CCOC(=O)c1cc(C(F)F)nn1CCOC

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
GAA P10253 3/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 6/20 0.40
POLB P06746 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SLC34A1 Q06495 2/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 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
SCHEMBL31459447 0.83 HCAR3 (0.42) ALDH1A1GAAHPGDSMN1; SMN2KDM4E
SCHEMBL2519952 0.83 SMN1; SMN2 (0.47) ALDH1A1GAASMN1; SMN2POLBNPC1
SCHEMBL31459416 0.83 ALDH1A1 (0.41) ALDH1A1GAAHPGDSMN1; SMN2POLB
SCHEMBL27258465 0.82 ALDH1A1 (0.44) ALDH1A1GAAHPGDSMN1; SMN2POLB
SCHEMBL19994230 0.82 SMN1; SMN2 (0.48) ALDH1A1GAAHPGDSMN1; SMN2POLB
SCHEMBL18695261 0.81 TP53 (0.49) ALDH1A1GAAHPGDSMN1; SMN2POLB
SCHEMBL31459316 0.79 GAA (0.42) ALDH1A1GAAHPGDPOLBSLC34A1
SCHEMBL22637864 0.78 ALDH1A1 (0.42) ALDH1A1GAAHPGDSMN1; SMN2POLB
SCHEMBL31459342 0.76 ALDH1A1 (0.42) ALDH1A1GAAHPGDSMN1; SMN2POLB
SCHEMBL16815462 0.75 GAA (0.41) ALDH1A1GAASMN1; SMN2POLBNPC1

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-2025096662-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-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