SCHEMBL8234604

SCHEMBL8234604

CC(=N)CC(N)CCC(N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PMP22 Q01453 2/20 0.46
GRIK1 P39086 2/20 0.43
GSR P00390 2/20 0.43
CYP1A2 P05177 2/20 0.43
GRM8 O00222 1/20 0.43
GRM6 O15303 1/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRM5 P41594 1/20 0.43
GRIA1 P42261 1/20 0.43
GRIA2 P42262 1/20 0.43
GRIA3 P42263 1/20 0.43
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
GRIA4 P48058 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIK2 Q13002 1/20 0.43
GRIK3 Q13003 1/20 0.43

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
SCHEMBL26960106 0.81
SCHEMBL27431432 0.81
SCHEMBL16577960 0.80 GRIK1 (0.45) PMP22GRIK1GSRCYP1A2GRM8
SCHEMBL4436708 0.79 GSR (0.56) PMP22GRIK1GSRCYP1A2GRM8
SCHEMBL9223551 0.79 GSR (0.56) PMP22GRIK1GSRCYP1A2GRM8
SCHEMBL1275773 0.79 PMP22 (0.52) PMP22GRIK1GSRCYP1A2GRM8
SCHEMBL1275775 0.79 PMP22 (0.52) PMP22GRIK1GSRCYP1A2GRM8
Hydrochloric Acid SCHEMBL6541739 0.77 PMP22 (0.50) PMP22GRIK1GSRCYP1A2GRM8
SCHEMBL602426 0.75 GSR (0.68) PMP22GRIK1GSRCYP1A2GRM8
SCHEMBL8068164 0.75 GSR (0.68) PMP22GRIK1GSRCYP1A2GRM8

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220411469-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES AMBRX, INC. (US) 2022-12-29 US disclosed
US-20220033518-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN ANTIBODY DRUG CONJUGATES AMBRX,INC. (US) 2022-02-03 US disclosed
EP-3170821-B1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES AMBRX INC (US) 2021-09-15 EP disclosed
US-20210277056-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES AMBRX, INC. (US) 2021-09-09 US disclosed
US-10954270-B2 Compositions containing, methods involving, and uses of non-natural amino acid linked dolastatin derivatives AMBRX, INC. (US) 2021-03-23 US disclosed
US-10800856-B2 Prostate-specific membrane antigen antibody drug conjugates AMBRX, INC. (US) 2020-10-13 US disclosed
EP-3536700-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN ANTIBODY DRUG CONJUGATES Ambrx, Inc. (US) 2019-09-11 EP disclosed
EP-3470413-A2 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES Ambrx, Inc. (US) 2019-04-17 EP disclosed
US-10208123-B2 Anti-CD70 antibody drug conjugates AMBRX, INC. (US) 2019-02-19 US disclosed
US-9796754-B2 Compositions containing, methods involving, and uses of non-natural amino acid linked dolastatin derivatives AMBRX, INC. (US) 2017-10-24 US disclosed
EP-3170821-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES Ambrx, Inc. (US) 2017-05-24 EP disclosed
US-20150152187-A1 Anti-PSMA Antibodies Conjugated to Nuclear Receptor Ligand Polypeptides AMBRX, INC. (US) 2015-06-04 US disclosed
US-20150152190-A1 Prostate-Specific Membrane Antigen Antibody Drug Conjugates AMBRX, INC. (US) 2015-06-04 US disclosed
US-20150141624-A1 Anti-CD70 Antibody Drug Conjugates AMBRX, INC. (US) 2015-05-21 US disclosed
US-20150141624-A1 Anti-CD70 Antibody Drug Conjugates AMBRX, INC. (US) 2015-05-21 US disclosed
US-20150080559-A1 Compositions Containing, Methods Involving, and Uses of Non-Natural Amino Acid Linked Dolastatin Derivatives AMBRX, INC. (US) 2015-03-19 US disclosed
WO-2012166560-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES AMBRX, INC. (US) 2012-12-06 WO disclosed
WO-2012166559-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES AMBRX, INC. (US) 2012-12-06 WO disclosed
WO-2007079130-A2 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACIDS AND POLYPEPTIDES AMBRX, INC. (US) 2007-07-12 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 (10 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-20220411469-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES DDOST, DAD1, PTMS PMP22 4665/4885GRIK1 3946/4885GSR 2829/4885
US-20150141624-A1 Anti-CD70 Antibody Drug Conjugates CD74, CD63, CD47 PMP22 2096/4885GRIK1 4775/4885GSR 4873/4885
US-20150152187-A1 Anti-PSMA Antibodies Conjugated to Nuclear Receptor Ligand Polypeptides AR, PSMA1, NR2E3 PMP22 3783/4885GRIK1 2169/4885GSR 3068/4885
US-10208123-B2 Anti-CD70 antibody drug conjugates CD74, CD63, CD47 PMP22 2096/4885GRIK1 4775/4885GSR 4873/4885
US-10800856-B2 Prostate-specific membrane antigen antibody drug conjugates KLK3, PTMS, DDOST PMP22 3671/4885GRIK1 4418/4885GSR 3119/4885
US-20210277056-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES DDOST, DAD1, PTMS PMP22 4665/4885GRIK1 3946/4885GSR 2829/4885
US-10954270-B2 Compositions containing, methods involving, and uses of non-natural amino acid linked dolastatin derivatives DDOST, DAD1, PTMS PMP22 4665/4885GRIK1 3946/4885GSR 2829/4885
US-20220033518-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN ANTIBODY DRUG CONJUGATES KLK3, PTMS, DDOST PMP22 3671/4885GRIK1 4418/4885GSR 3119/4885
US-20150152190-A1 Prostate-Specific Membrane Antigen Antibody Drug Conjugates KLK3, PTMS, DDOST PMP22 3671/4885GRIK1 4418/4885GSR 3119/4885
US-20150080559-A1 Compositions Containing, Methods Involving, and Uses of Non-Natural Amino Acid Linked Dolastatin Derivatives DDOST, DAD1, PTMS PMP22 4654/4885GRIK1 3962/4885GSR 2869/4885

“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.