SCHEMBL24051981

SCHEMBL24051981

Nc1ccc(C(=O)N2CCCC(CO)C2)c(O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
GRM3 Q14832 3/20 0.45
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
EPHX2 P34913 5/20 0.43
RXFP1 Q9HBX9 1/20 0.42
CSNK2A2 P19784 1/20 0.42
CSNK2A1 P68400 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 2/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41
ESR2 Q92731 1/20 0.41
PTPN1 P18031 1/20 0.41

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
SCHEMBL12156579 0.80 GRM3 (0.61) ALDH1A1HPGDGRM3KDM4EMEN1
SCHEMBL25753330 0.79 ALDH1A1 (0.47) ALDH1A1HPGDGRM3KDM4EMEN1
SCHEMBL4155107 0.79 HSP90AA1 (0.50) ALDH1A1HPGDPDK1PDK2PDK3
SCHEMBL10722354 0.78 EPHX2 (0.54) ALDH1A1GRM3EPHX2L3MBTL1NPC1
SCHEMBL12260989 0.78 GRM3 (0.45) ALDH1A1GRM3EPHX2CSNK2A2CSNK2A1
SCHEMBL487910 0.78 EPHX2 (0.56) ALDH1A1GRM3KMT2AEPHX2RXFP1
SCHEMBL10724293 0.75 GRM3 (0.68) ALDH1A1HPGDGRM3KDM4EMEN1
SCHEMBL10723661 0.73 GRM3 (0.56) ALDH1A1GRM3KMT2AEPHX2L3MBTL1
SCHEMBL2729282 0.72 CYP2C9 (0.60) SMN1; SMN2
SCHEMBL14817969 0.69 GRM3 (0.61) ALDH1A1HPGDGRM3KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023220440-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-11-16 WO disclosed
WO-2023091644-A2 HSD17B13-RELATED DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-05-25 WO disclosed
WO-2023049218-A1 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-03-30 WO disclosed
WO-2022099159-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2022-05-12 WO disclosed
WO-2021234459-A9 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2022-02-03 WO disclosed
WO-2021234459-A2 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2021-11-25 WO disclosed
WO-2021237223-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2021-11-25 WO disclosed