SCHEMBL22946803

SCHEMBL22946803

CCCCCC(C)(CCCCC)n1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 3/20 0.47
▸ MAPK1 P28482 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ CYP2C19 P33261 4/20 0.37
▸ CYP1A2 P05177 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ SHMT2 P34897 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SQOR Q9Y6N5 1/20 0.36
▸ TK2 O00142 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HSD17B10 Q99714 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
SCHEMBL22946795 0.98 TK1 (0.49) TK1MAPK1HPGDCYP2C19CYP1A2
SCHEMBL25799801 0.97 TK1 (0.48) TK1MAPK1HPGDCYP2C19CYP1A2
SCHEMBL22020961 0.96 TK1 (0.47) TK1MAPK1CYP2C19CYP1A2GAA
SCHEMBL22380811 0.93 TK1 (0.47) TK1MAPK1CYP2C19CYP1A2GAA
SCHEMBL22260568 0.93 TK1 (0.43) TK1MAPK1HPGDCYP2C19CYP1A2
SCHEMBL26793575 0.89 MAPK1 (0.41) TK1MAPK1HPGDALDH1A1TK2
SCHEMBL22666437 0.87 TK1 (0.49) TK1MAPK1HPGDCYP2C19CYP1A2
SCHEMBL25824829 0.84 CYP2C19 (0.39) TK1CYP2C19CYP1A2GAAMEN1
SCHEMBL22198654 0.83 TK1 (0.39) TK1MAPK1HPGDALDH1A1TK2
SCHEMBL21090689 0.83 TK1 (0.39) TK1MAPK1HPGDALDH1A1TK2

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-11739325-B2 Oligonucleotide compositions and methods thereof WAVE LIFE SCIENCES LTD. (SG) 2023-08-29 — — US disclosed
US-20210032620-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2021-02-04 — — US disclosed
Send feedback