SCHEMBL38650561

SCHEMBL38650561

CCOCCOCCOCCOCCOCCNC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.47
CA12 O43570 5/20 0.45
CA1 P00915 5/20 0.45
CA2 P00918 5/20 0.45
CA9 Q16790 5/20 0.45
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
IDO1 P14902 1/20 0.43
EPHX1 P07099 1/20 0.42
BCHE P06276 1/20 0.41
CNR2 P34972 1/20 0.41
ADRB2 P07550 1/20 0.41
HTR1A P08908 1/20 0.41

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
SCHEMBL14065889 1.00 TDP1 (0.50) TDP1MEN1KMT2AGAACA12
SCHEMBL25985418 1.00 TDP1 (0.50) TDP1MEN1KMT2AGAACA12
SCHEMBL22997280 1.00 TDP1 (0.50) TDP1MEN1KMT2AGAACA12
SCHEMBL10073751 0.96 TDP1 (0.53) TDP1MEN1KMT2AGAACA12
SCHEMBL30917974 0.93 TDP1 (0.51) TDP1MEN1KMT2AGAACA12
SCHEMBL12885084 0.93 TDP1 (0.56) TDP1MEN1KMT2AGAACA12
SCHEMBL22276641 0.93 TDP1 (0.56) TDP1MEN1KMT2AGAACA12
SCHEMBL22276648 0.93 TDP1 (0.56) TDP1MEN1KMT2AGAACA12
SCHEMBL13055393 0.91 TDP1 (0.58) TDP1MEN1KMT2AGAACA12
SCHEMBL18591853 0.89 TDP1 (0.50) TDP1MEN1KMT2AGAACA12

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-120590466-B Compound of targeted fibroblast activation protein and application thereof 首都医科大学脑重大疾病研究中心(北京脑重大疾病研究院) 2026-05-12 CN disclosed