SCHEMBL28577904

SCHEMBL28577904

NCCOCCOCCOCCOCCOCCSSc1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.47
EHMT1 Q9H9B1 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
ALDH1A1 P00352 3/20 0.36
HRH1 P35367 2/20 0.35
LMNA P02545 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HDAC1 Q13547 3/20 0.34
HDAC2 Q92769 3/20 0.34
KMT2A Q03164 3/20 0.33
TAAR1 Q96RJ0 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MEN1 O00255 2/20 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
SCHEMBL14125327 1.00 EHMT2 (0.47) EHMT2EHMT1APOBEC3GALDH1A1HRH1
SCHEMBL10326593 0.92 EHMT2 (0.55) EHMT2EHMT1APOBEC3GALDH1A1LMNA
SCHEMBL12893463 0.91 EHMT2 (0.44) EHMT2EHMT1APOBEC3GALDH1A1HRH1
SCHEMBL11821480 0.91 EHMT2 (0.57) EHMT2EHMT1APOBEC3GALDH1A1LMNA
SCHEMBL9889211 0.89 EHMT2 (0.42) EHMT2EHMT1APOBEC3GHRH1HDAC1
Hydrochloric Acid SCHEMBL1258392 0.88 EHMT2 (0.41) EHMT2EHMT1APOBEC3GHRH1HDAC1
SCHEMBL31456218 0.85 EHMT2 (0.47) EHMT2EHMT1APOBEC3GALDH1A1LMNA
SCHEMBL15140934 0.85 EHMT2 (0.47) EHMT2EHMT1APOBEC3GALDH1A1LMNA
SCHEMBL31290207 0.85 EHMT2 (0.47) EHMT2EHMT1APOBEC3GALDH1A1LMNA
SCHEMBL30195622 0.85 EHMT2 (0.47) EHMT2EHMT1APOBEC3GALDH1A1LMNA

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-113039191-A Nucleotide analogs 奇异基因组学系统公司 2021-06-25 CN disclosed