SCHEMBL8908479

SCHEMBL8908479

CC(C)(S)CNC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA7 P43166 1/20 0.43
CTSK P43235 6/20 0.40
CTSS P25774 4/20 0.40
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
EPHX1 P07099 1/20 0.40
CYP2D6 P10635 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL22488319 0.85 TDP1 (0.47) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL24391425 0.83 TDP1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL21065336 0.82 TDP1 (0.52) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL842921 0.82 TDP1 (0.52) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL255203 0.82 TDP1 (0.52) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL16266905 0.80 TDP1 (0.50) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL26862839 0.80 TDP1 (0.50) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL20687292 0.79 TDP1 (0.46) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL5509686 0.79 MAOA (0.47) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL5548918 0.79 MEN1 (0.47) 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4237008-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF Elucida Oncology, Inc. (US) 2023-09-06 EP disclosed
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 US disclosed
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 US disclosed
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 US disclosed
US-20230148277-A1 DISULFIDE BOND CONTAINING COMPOUNDS AND USES THEREOF THE UNIVERSITY OF QUEENSLAND (AU) 2023-05-11 US disclosed
US-20230148277-A1 DISULFIDE BOND CONTAINING COMPOUNDS AND USES THEREOF THE UNIVERSITY OF QUEENSLAND (AU) 2023-05-11 US disclosed
US-11566044-B2 Disulfide bond containing compounds and uses thereof THE UNIVERSITY OF QUEENSLAND (AU) 2023-01-31 US disclosed
WO-2022093800-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. (US) 2022-05-05 WO disclosed
WO-2022093800-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. (US) 2022-05-05 WO disclosed
US-20200207810-A1 DISULFIDE BOND CONTAINING COMPOUNDS AND USES THEREOF THE UNIVERSITY OF QUEENSLAND (AU) 2020-07-02 US disclosed
WO-2019018892-A1 DISULFIDE BOND CONTAINING COMPOUNDS AND USES THEREOF THE UNIVERSITY OF QUEENSLAND (AU) 2019-01-31 WO disclosed
US-5688946-A DIPEPTIDES FOR HYPOTENSIVE AGENTS AND CARDIOVASCULAR DISORDERS HOFFMANN LA ROCHE INC. (US) 1997-11-18 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 (4 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-20200207810-A1 DISULFIDE BOND CONTAINING COMPOUNDS AND USES THEREOF P4HB, PTMS, PDIA6 TDP1 4743/4885MAOA 4119/4885MAOB 3321/4885
US-11566044-B2 Disulfide bond containing compounds and uses thereof P4HB, PTMS, PDIA6 TDP1 4743/4885MAOA 4119/4885MAOB 3321/4885
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF NDC1, KIFC1, SDCBP TDP1 1064/4885MAOA 1972/4885MAOB 2044/4885
US-20230148277-A1 DISULFIDE BOND CONTAINING COMPOUNDS AND USES THEREOF P4HB, PTMS, PDIA6 TDP1 4743/4885MAOA 4119/4885MAOB 3321/4885

“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.