SCHEMBL1955692

SCHEMBL1955692

C=CC(N)N1C(=O)C=CC1=O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ MGLL Q99685 1/20 0.31

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
Hydrochloric Acid SCHEMBL10491222 1.00 GSK3A (0.31) GSK3AGSK3BMGLL
Hydrochloric Acid SCHEMBL28815853 0.75 MGLL (0.36) GSK3AGSK3BMGLL
SCHEMBL27421027 0.72 MGLL (0.38) GSK3AGSK3BMGLL
SCHEMBL9414032 0.71 GSK3A (0.31) GSK3AGSK3BMGLL
SCHEMBL3813596 0.71 MGLL (0.32) GSK3AGSK3BMGLL
SCHEMBL822300 0.71 GSK3A (0.31) GSK3AGSK3BMGLL
SCHEMBL8989652 0.71 GSK3A (0.31) GSK3AGSK3BMGLL
Hydrochloric Acid SCHEMBL354779 0.70 MGLL (0.39) GSK3AGSK3BMGLL
SCHEMBL3259474 0.70 CASP3 (0.44) —
SCHEMBL27580159 0.68 MGLL (0.33) GSK3AGSK3BMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020192703-A1 Immunoassay reagents and methods for determination of LSD and LSD metabolites MICROGENICS CORPORATION 2002-12-19 — — US claimed
EP-0820984-B1 Activated amphetamines ROCHE DIAGNOSTICS GMBH (DE) 2002-03-27 — — EP claimed
EP-0429611-B1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS ROCHE DIAGNOSTICS GMBH (DE) 2001-02-28 — — EP claimed
US-5595741-A Aminoalkylmaleimides and hapten and antigen derivatives derived therefrom as well as conjugates with peptides or proteins BOEHRINGER MANNHEIM GMBH (DE) 1997-01-21 — — US claimed
EP-0429611-A1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS Roche Diagnostics GmbH (DE) 1991-06-05 — — EP claimed
WO-1990015798-A1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS BOEHRINGER MANNHEIM GMBH (DE) 1990-12-27 — — WO claimed
US-20240059732-A1 Antibody-Drug Conjugates Including Hemiasterlin Derivative Sumitomo Pharma Co., Ltd. (JP) 2024-02-22 — — US disclosed
EP-3666787-B1 ANTIBODY-DRUG CONJUGATES INCLUDING HEMIASTERLIN DERIVATIVE SUMITOMO PHARMA CO LTD (JP) 2024-02-21 — — EP disclosed
US-11795195-B2 Antibody-drug conjugates including hemiasterlin derivative Sumitomo Pharma Co., Ltd. (JP) 2023-10-24 — — US disclosed
US-20230050863-A1 DICATIONIC FLUORESCENT DYES ROCHE MOLECULAR SYSTEMS, INC. 2023-02-16 — — US disclosed
US-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-06-30 — — US disclosed
US-20220144889-A1 Hemiasterlin Derivative Having Cysteine Residue SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-05-12 — — US disclosed
EP-3925668-A1 HEMIASTERLIN DERIVATIVE HAVING CYSTEINE RESIDUE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2021-12-22 — — EP disclosed
EP-0742903-A1 PIPERIDINE ANALOGS AND CONJUGATES OF PROCAINAMIDE AND NAPA BOEHRINGER MANNHEIM CORPORATION (US) 1996-11-20 — — EP disclosed
US-5525474-A IMMUNOASSAY; LINKING THE HAPTENIC DRUG VIA ITS MALEIMIDE MOIETY AND A SULFHYDRYL BRIDGE TO AN IMMUNOGENIC CARRIER TO STIMULATE ANTIBODIES BOEHRINGER MANNHEIM CORPORATION (US) 1996-06-11 — — US disclosed
WO-1995020763-A1 PIPERIDINE ANALOGS AND CONJUGATES OF PROCAINAMIDE AND NAPA BOEHRINGER MANNHEIM CORPORATION (US) 1995-08-03 — — WO disclosed
EP-0429611-A1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS Roche Diagnostics GmbH (DE) 1991-06-05 — — EP disclosed
EP-0429611-A1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS Roche Diagnostics GmbH (DE) 1991-06-05 — — EP disclosed
WO-1990015798-A1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS BOEHRINGER MANNHEIM GMBH (DE) 1990-12-27 — — WO disclosed
WO-1990015798-A1 AMINOALKYL MALEIMIDES AND HAPTENE AND ANTIGEN DERIVATIVES THEREOF AND CONJUGATES WITH PEPTIDES OR PROTEINS BOEHRINGER MANNHEIM GMBH (DE) 1990-12-27 — — 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 (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-20220144889-A1 Hemiasterlin Derivative Having Cysteine Residue SHBG, CYP11A1, CYP11B1 GSK3A 2144/4885GSK3B 2216/4885MGLL 2576/4885
US-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells POU5F1, POU2F1, POU2F2 GSK3A 1841/4885GSK3B 1765/4885MGLL 4650/4885
US-11795195-B2 Antibody-drug conjugates including hemiasterlin derivative HSD3B2, HSD3B1, HSD11B2 GSK3A 333/4885GSK3B 229/4885MGLL 4801/4885
US-20240059732-A1 Antibody-Drug Conjugates Including Hemiasterlin Derivative HSD3B2, HSD3B1, HSD11B2 GSK3A 333/4885GSK3B 229/4885MGLL 4801/4885

“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.

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