SCHEMBL22927893

SCHEMBL22927893

CNC(=O)CNC(=O)CNC(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
NPFFR1 Q9GZQ6 1/20 0.38
NPFFR2 Q9Y5X5 1/20 0.38
CA2 P00918 4/20 0.38
CA12 O43570 4/20 0.38
CA14 Q9ULX7 2/20 0.38
APLNR P35414 1/20 0.38
CA1 P00915 4/20 0.37
CA9 Q16790 2/20 0.37
EPHX1 P07099 1/20 0.37
CA7 P43166 2/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL21602768 1.00 TDP1 (0.44) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL1950351 0.96 TDP1 (0.47) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL23332545 0.86 TDP1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL11566314 0.85 CA12 (0.53) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL20126924 0.85 TDP1 (0.44) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL1000860 0.85 MEN1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL999017 0.85 MEN1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL1486144 0.85 MEN1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL8500219 0.85 MEN1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL15712063 0.85 TDP1 (0.44) TDP1MAOAMAOBMEN1KMT2A

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-20210023231-A1 DEGRADABLE POLYETHYLENE GLYCOL CONJUGATE NOF CORPORATION (JP) 2021-01-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210023231-A1 DEGRADABLE POLYETHYLENE GLYCOL CONJUGATE LNPEP, CD68, CD4 TDP1 3913/4885MAOA 3421/4885MAOB 2957/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.