SCHEMBL24596802

SCHEMBL24596802

CC(C)(C)SSc1ccccc1CO

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.67
SLC6A4 P31645 6/20 0.40
SLC6A2 P23975 3/20 0.36
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
TXN P10599 1/20 0.35
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
IFNAR1 P17181 1/20 0.33
LDHA P00338 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
NPY1R P25929 1/20 0.33
MAPK1 P28482 1/20 0.33
NPY2R P49146 1/20 0.33
CETP P11597 1/20 0.33
KLF10 Q13118 1/20 0.32

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
SCHEMBL16710787 0.85 APOBEC3G (0.47) APOBEC3GSLC6A4SLC6A2TXNHTR2A
SCHEMBL7262305 0.81 APOBEC3G (1.00) APOBEC3GSLC6A4SLC6A2PDCD1CD274
SCHEMBL18762910 0.81 APOBEC3G (0.41) APOBEC3GTXNHTR2AHTR2CHTR2B
SCHEMBL9634657 0.80 APOBEC3G (0.59) APOBEC3GSLC6A4SLC6A2PDCD1CD274
SCHEMBL4901824 0.78 APOBEC3G (0.75) APOBEC3GSLC6A4SLC6A2PDCD1CD274
SCHEMBL19924405 0.75 MTNR1A (0.43) APOBEC3GLMNACETP
SCHEMBL19923848 0.74 RIPK1 (0.40) APOBEC3GSLC6A4SLC6A2ALDH1A1LMNA
SCHEMBL16710910 0.74 ALDH1A1 (0.41) APOBEC3GTXNALDH1A1LMNAMAPK1
SCHEMBL16710794 0.73 APOBEC3G (0.41) APOBEC3GSLC6A4SLC6A2PDCD1CD274
SCHEMBL29308257 0.73 CETP (0.44) ALDH1A1LMNAMAPK1CETP

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
WO-2022147223-A2 2'-MODIFIED NUCLEOSIDE BASED OLIGONUCLEOTIDE PRODRUGS ALNYLAM PHARMACEUTICALS, INC. (US) 2022-07-07 WO disclosed