SCHEMBL31410101

SCHEMBL31410101

Cn1ccnc1C(C)(NC=O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
HDAC4 P56524 1/20 0.32
TSHR P16473 1/20 0.32
FDPS P14324 2/20 0.32
PKM P14618 1/20 0.32
MAPK1 P28482 1/20 0.32
LPO P22079 1/20 0.31
NAMPT P43490 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
MEN1 O00255 1/20 0.31
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
SCHEMBL1083384 0.75 KMT2A (0.50) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL8283637 0.70 KMT2A (0.45) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL28784054 0.70 KMT2A (0.45) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL12928752 0.68 KMT2A (0.46) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL8415398 0.67 KMT2A (0.56) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL11050545 0.67 KMT2A (0.56) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL29393799 0.67 KMT2A (0.45) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL22863264 0.66 KMT2A (0.50) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL419709 0.66 KMT2A (0.50) KMT2ATSHRFDPSPKMMAPK1
SCHEMBL23367672 0.66 KMT2A (0.33) KMT2A

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-2025076219-A1 METHODS AND COMPOUNDS FOR MODULATING HUNTINGTON'S DISEASE Design Therapeutics, Inc. (US) 2025-04-10 WO disclosed