SCHEMBL903407

SCHEMBL903407

CO[C@@H]([C@@H]1CCCN1)[C@@H](C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.40
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 2/20 0.40
DHFR P00374 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL17337530 1.00 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL17581727 1.00 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL17337527 1.00 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
Hydrochloric Acid SCHEMBL6256332 0.98 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
Hydrochloric Acid SCHEMBL4369880 0.98 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
Trifluoroacetic Acid SCHEMBL13734001 0.91 SLC6A3 (0.36) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL25833946 0.87 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL23987692 0.85 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL22625783 0.85 SLC6A3 (0.38) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL15292983 0.85 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4DHFRALDH1A1

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 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4051691-B1 DOLASTATIN 10 ANALOG ARIEL SCIENT INNOVATIONS LTD (IL) 2025-02-12 EP claimed
US-20230000995-A1 DOLASTATIN 10 ANALOG Ariel Scientific Innovations Ltd. (IL) 2023-01-05 US claimed
WO-2025109604-A1 DOLASTATIN 10 ANALOGS Ariel Scientific Innovations Ltd. (IL) 2025-05-30 WO disclosed
EP-4051691-B1 DOLASTATIN 10 ANALOG ARIEL SCIENT INNOVATIONS LTD (IL) 2025-02-12 EP disclosed
US-20230317700-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2023-10-05 US disclosed
EP-4253421-A2 ANTI-HER2 BIPARATOPIC ANTIBODY-DRUG CONJUGATES AND METHODS OF USE Zymeworks BC Inc. (CA) 2023-10-04 EP disclosed
EP-4253421-A2 ANTI-HER2 BIPARATOPIC ANTIBODY-DRUG CONJUGATES AND METHODS OF USE Zymeworks BC Inc. (CA) 2023-10-04 EP disclosed
WO-2023172951-A1 METHODS OF TREATING SOLID TUMORS WITH ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES EXELIXIS, INC. (US) 2023-09-14 WO disclosed
WO-2023172951-A1 METHODS OF TREATING SOLID TUMORS WITH ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES EXELIXIS, INC. (US) 2023-09-14 WO disclosed
WO-2023141517-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES EXELIXIS, INC. (US) 2023-07-27 WO disclosed
WO-2023141517-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES EXELIXIS, INC. (US) 2023-07-27 WO disclosed
WO-2013072813-A2 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER INC. (US) 2013-05-23 WO disclosed
WO-2013072813-A2 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER INC. (US) 2013-05-23 WO disclosed
US-20130129753-A1 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER INC. (US) 2013-05-23 US disclosed
US-20130129753-A1 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER INC. (US) 2013-05-23 US disclosed
EP-2579887-A1 NOVEL AURISTATIN DERIVATIVES AND USE THEREOF Seattle Genetics, Inc. (US) 2013-04-17 EP disclosed
WO-2012123423-A1 N-CARBOXYALKYL-AURISTATINS AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-09-20 WO disclosed
WO-2012041805-A1 N-CARBOXYALKYL AURISTATINS AND THE USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-04-05 WO disclosed
WO-2011154359-A1 NOVEL AURISTATIN DERIVATIVES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-15 WO disclosed
WO-2011154359-A1 NOVEL AURISTATIN DERIVATIVES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-15 WO 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 (2 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-20130129753-A1 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF NGLY1, CD47, CD81 SLC6A3 2545/4885SLC6A2 2302/4885SLC6A4 2468/4885
US-20230000995-A1 DOLASTATIN 10 ANALOG DDOST, DAD1, ALG8 SLC6A3 1642/4885SLC6A2 1907/4885SLC6A4 1276/4885

“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.