SCHEMBL9066818

SCHEMBL9066818

O=C(OC1OCCS1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.43
APOBEC3A P31941 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
CHRNA7 P36544 2/20 0.43
LMNA P02545 2/20 0.42
F2 P00734 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.42
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
TSHR P16473 1/20 0.40
GRM5 P41594 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
SLC18A3 Q16572 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38

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
SCHEMBL2533715 0.82 TDP1 (0.45) LMNAKMT2AALDH1A1
SCHEMBL1930837 0.75 F2 (0.48) BCHEAPOBEC3AAPOBEC3GCHRNA7LMNA
SCHEMBL2574686 0.74 CHRNA7 (0.50) BCHEAPOBEC3AAPOBEC3GCHRNA7LMNA
SCHEMBL1088261 0.73 TDP1 (0.45) CHRNA7LMNAMEN1KMT2ATSHR
SCHEMBL1087816 0.73 TDP1 (0.45) CHRNA7LMNAMEN1KMT2ATSHR
SCHEMBL1087819 0.73 TDP1 (0.45) CHRNA7LMNAMEN1KMT2ATSHR
SCHEMBL10338863 0.73 BCHE (0.53) BCHEAPOBEC3AAPOBEC3GCHRNA7LMNA
SCHEMBL30669504 0.72 CHRNA7 (0.49) APOBEC3AAPOBEC3GCHRNA7LMNAF2
SCHEMBL11632239 0.72 BCHE (0.46) BCHEAPOBEC3AAPOBEC3GCHRNA7LMNA
SCHEMBL10995636 0.72 BCHE (0.51) BCHEAPOBEC3AAPOBEC3GCHRNA7LMNA

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
US-5587480-A TREATING HIV AND HEPATITIS VIRUS INFECTIONS BIOCHEM PHARMA, INC. (CA) 1996-12-24 US disclosed