SCHEMBL28966331

SCHEMBL28966331

NC(O)(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.65
CA2 P00918 2/20 0.52
CAMK2A Q9UQM7 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.47
HIF1A Q16665 1/20 0.47
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
ESR1 P03372 6/20 0.47
SLC7A5 Q01650 1/20 0.44
CTBP2 P56545 1/20 0.43
ESR2 Q92731 5/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
EGFR P00533 1/20 0.42
CYP1A2 P05177 1/20 0.42
FYN P06241 1/20 0.42
POLB P06746 1/20 0.42
CYP3A4 P08684 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
SCHEMBL17768418 1.00 BLM (0.65) BLMCA2CAMK2ASMN1; SMN2HIF1A
SCHEMBL2336417 0.83 SMN1; SMN2 (0.67) BLMSMN1; SMN2HIF1AMEN1CYP1A2
SCHEMBL17498702 0.83 SMN1; SMN2 (0.67) BLMSMN1; SMN2HIF1AMEN1CYP1A2
SCHEMBL16816903 0.83 SMN1; SMN2 (0.67) BLMSMN1; SMN2HIF1AMEN1CYP1A2
SCHEMBL7387615 0.82 BLM (0.67) BLMCA2CAMK2ASMN1; SMN2HIF1A
SCHEMBL7436157 0.81 BLM (0.51) BLMCA2CAMK2AFNTAFNTB
SCHEMBL24253146 0.78 BLM (0.62) BLMCA2CAMK2ASMN1; SMN2HIF1A
SCHEMBL20292653 0.78 BLM (0.62) BLMCA2CAMK2ASMN1; SMN2HIF1A
SCHEMBL17768416 0.78 BLM (0.62) BLMCA2CAMK2ASMN1; SMN2HIF1A
Racemetyrosine SCHEMBL61871 0.78 BLM (1.00) BLMCA2CAMK2ASMN1; SMN2HIF1A

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
CN-115605493-A Prodrugs of4'-C-substituted-2-halo-2' -deoxyadenosine nucleosides and methods of making and using the same 吉利德科学公司(US) 2023-01-13 CN disclosed