SCHEMBL29119321

SCHEMBL29119321

CCCC#CCCOC(=O)CCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.45
ALDH1A1 P00352 2/20 0.44
ADRA2A P08913 1/20 0.39
ADRA1A P35348 1/20 0.39
DNM1 Q05193 1/20 0.38
MAPT P10636 2/20 0.38
BLM P54132 1/20 0.38
HTR2C P28335 1/20 0.37
NAAA Q02083 1/20 0.36
PTPN7 P35236 3/20 0.34
HMGCR P04035 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PAM P19021 2/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
MGLL Q99685 1/20 0.33
PRSS1 P07477 1/20 0.33

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
SCHEMBL10900385 0.90 DGKA (0.44) DGKAALDH1A1ADRA2AADRA1ADNM1
SCHEMBL28859218 0.88 DGKA (0.52) DGKAALDH1A1DNM1MAPTBLM
SCHEMBL29119052 0.86 DGKA (0.55) DGKAALDH1A1DNM1MAPTBLM
SCHEMBL29119191 0.86 DGKA (0.66) DGKAALDH1A1DNM1MAPTNAAA
SCHEMBL30592506 0.85 DGKA (0.69) DGKAALDH1A1DNM1MAPTHTR2C
SCHEMBL29119270 0.83 ALDH1A1 (0.44) DGKAALDH1A1MAPTBLMPTPN7
SCHEMBL28162525 0.83 DGKA (0.45) DGKAALDH1A1ADRA2AADRA1ADNM1
SCHEMBL24588642 0.82 DGKA (0.55) DGKAALDH1A1DNM1MAPTPTPN7
SCHEMBL5255942 0.81 DGKA (0.47) DGKAALDH1A1ADRA2AADRA1ADNM1
SCHEMBL28413680 0.80 TSHR (0.36) DGKAALDH1A1MAPTBLMNAAA

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-116887841-A Nanomaterials comprising ester-linked acetals 比姆医疗股份有限公司 2023-10-13 CN disclosed