SCHEMBL31459639

SCHEMBL31459639

[H]/N=C(/Cc1c(C)cccc1F)NO

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.35
ACHE P22303 1/20 0.34
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK14 Q16539 1/20 0.30
EED O75530 1/20 0.30
POLB P06746 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
SCHEMBL837843 0.76 BACE1 (0.39) NPC1RAB9ASMN1; SMN2POLB
SCHEMBL31459664 0.71 HTR1D (0.44) ACHENPC1RAB9APKMSMN1; SMN2
SCHEMBL31737438 0.71 ACHE (0.43) HDAC4ACHEHDAC3HDAC1HDAC2
SCHEMBL19290092 0.69 ACHE (0.41) HDAC4ACHENPC1RAB9APKM
SCHEMBL28153560 0.69 KDM4E (0.50) ACHESMN1; SMN2
SCHEMBL28724963 0.69 SMN1; SMN2 (0.51) SMN1; SMN2MAPK14POLB
SCHEMBL2087457 0.68 ACHE (0.48) HDAC4ACHEPKMSMN1; SMN2EED
SCHEMBL31459659 0.66 LMNA (0.42) ACHEPKMSMN1; SMN2EED
SCHEMBL22763796 0.66 ACHE (0.50) ACHEPKMSMN1; SMN2EED
SCHEMBL170719 0.66 ACHE (0.50) ACHEPKMSMN1; SMN2EED

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025096658-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