SCHEMBL25823735

SCHEMBL25823735

C=C(NC)c1cn(C(C)(C)C)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MEN1 O00255 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ CYP1A2 P05177 3/20 0.30
▸ CYP2C19 P33261 3/20 0.30
▸ GAA P10253 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL25823897 0.82 KMT2A (0.36) KMT2ACYP2C9MAPTMEN1HTT
SCHEMBL20792485 0.73 KMT2A (0.34) KMT2ACYP2C9MAPTMEN1HTT
SCHEMBL24420455 0.70 DAO (0.40) KMT2ACYP2C9MAPTMEN1GAA
SCHEMBL25823734 0.69 ALDH1A1 (0.47) KMT2ACYP2C9MAPTMEN1HTT
SCHEMBL9910660 0.67 MAPK1 (0.44) —
SCHEMBL25826087 0.66 CYP2C19 (0.40) KMT2ACYP2C9MAPTMEN1CYP1A2
SCHEMBL25824824 0.66 CYP2C19 (0.35) KMT2ACYP2C9MAPTMEN1HTT
SCHEMBL25823728 0.66 KDM4E (0.56) KMT2ACYP2C9MEN1HTTCYP2C19
SCHEMBL22873334 0.66 TNKS (0.33) TDP1
SCHEMBL12702585 0.66 GRIA1 (0.39) KMT2AMAPTMEN1CYP1A2TDP1

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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