SCHEMBL25824045

SCHEMBL25824045

CC[C@H]1O[C@@H](n2cc(C(=O)NCc3ccccc3)c(=O)[nH]c2=O)[C@@H](O)C1O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 6/20 0.48
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ HINT1 P49773 1/20 0.44
▸ PYGM P11217 3/20 0.43
▸ DNPH1 O43598 1/20 0.43
▸ TK2 O00142 2/20 0.43
▸ P2RY6 Q15077 1/20 0.42

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
SCHEMBL25824050 0.85 PYGM (0.50) P2RY2PYGMDNPH1TK2P2RY6
SCHEMBL25824044 0.85 TK2 (0.42) P2RY2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10101281 0.82 TK2 (0.53) KDM4EALDH1A1PYGMTK2
SCHEMBL10104844 0.82 TK2 (0.53) KDM4EALDH1A1PYGMTK2
SCHEMBL29163657 0.82 TK2 (0.53) KDM4EALDH1A1PYGMTK2
SCHEMBL23215178 0.81 TYMP (0.55) P2RY2HINT1DNPH1P2RY6
SCHEMBL24420198 0.80 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL25697669 0.78 P2RY2 (0.42) P2RY2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL19768685 0.78 P2RY2 (0.42) P2RY2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL27093309 0.78 TK2 (0.48) P2RY2PYGMTK2

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
US-20240026358-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2024-01-25 — — US disclosed
US-20230220384-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-07-13 — — US disclosed
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