SCHEMBL17833858

SCHEMBL17833858

O=C(O)c1ccccc1CSSc1ccccn1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.57
GAA P10253 1/20 0.57
POLB P06746 1/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
EHMT2 Q96KQ7 1/20 0.46
EHMT1 Q9H9B1 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
CYP2C9 P11712 1/20 0.44
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
FOLH1 Q04609 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 1/20 0.40
APEX1 P27695 1/20 0.40

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
SCHEMBL16710901 0.78 APOBEC3G (0.52) ALDH1A1POLBKMT2AMEN1EHMT2
SCHEMBL28790425 0.78 EHMT2 (0.52) ALDH1A1POLBKMT2AMEN1EHMT2
SCHEMBL1746858 0.77 ALDH1A1 (0.35) ALDH1A1GAAPOLBKMT2AMEN1
SCHEMBL30695197 0.77 POLB (0.57) ALDH1A1POLBKMT2AMEN1EHMT2
SCHEMBL20141792 0.77 POLB (0.57) ALDH1A1POLBKMT2AMEN1EHMT2
SCHEMBL16938383 0.77 POLB (0.74) ALDH1A1GAAPOLBKMT2AMEN1
SCHEMBL31005447 0.77 POLB (0.74) ALDH1A1GAAPOLBKMT2AMEN1
SCHEMBL16710804 0.76 EHMT2 (0.48) ALDH1A1POLBKMT2AMEN1EHMT2
SCHEMBL19950561 0.75 POLB (0.67) ALDH1A1POLBKMT2AMEN1EHMT2
SCHEMBL1126669 0.75 EHMT2 (0.52) ALDH1A1GAAPOLBKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117866042-A Disulfide-containing cell penetrating peptides and methods of making and using the same 俄亥俄州国家创新基金会 2024-04-12 CN disclosed
CN-110114075-B Disulfide-containing cell penetrating peptides and methods of making and using the same 俄亥俄州国家创新基金会 2024-01-12 CN disclosed
US-20160168636-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION 2016-06-16 US disclosed
US-20160168636-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION 2016-06-16 US disclosed