SCHEMBL548963

SCHEMBL548963

CCC(CC)(C(=O)O)C(=O)C(=O)O.[NaH]

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32
FFAR3 O14843 1/20 0.32

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
SCHEMBL3062956 0.97 ALDH1A1 (0.38) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL2599668 0.83 ALDH1A1 (0.33) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL105436 0.83 FFAR3 (0.39) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL28314797 0.80 FFAR3 (0.37) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL28315783 0.80 FFAR3 (0.37) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL51201 0.80 FFAR3 (0.41) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL9307815 0.80 MEN1 (0.31) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL104624 0.77 FFAR3 (0.39) ALDH1A1TSHRMEN1CYP1A2THRB
SCHEMBL17818653 0.77 FFAR3 (0.39) ALDH1A1TSHRMEN1CYP1A2THRB
Hydrochloric Acid SCHEMBL8053454 0.77 FFAR3 (0.39) ALDH1A1TSHRMEN1CYP1A2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107602809-A High-solid content water-based polyurethane dispersion liquid a kind of while based on aminocarboxylate and sulfamate 温州大学 2018-01-19 CN claimed
US-4902819-A Preparation of sodium diethyl oxalacetate HOECHST CELANESE CORPORATION (US) 1990-02-20 US claimed
EP-4680608-A1 2,6-DIHYDRO-7H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE DERIVATIVES AS ANTI-MALARIAL AGENTS MMV Medicines for Malaria Venture (CH) 2026-01-21 EP disclosed
US-20240208990-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2024-06-27 US disclosed
EP-4347602-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME Solventum Intellectual Properties Company (US) 2024-04-10 EP disclosed
WO-2022248947-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-12-01 WO disclosed
EP-3359541-B1 N-SULFONYLATED PYRAZOLO[3,4-B]PYRIDIN-6-CARBOXAMIDES AND METHOD OF USE ABBVIE OVERSEAS SARL (LU) 2020-08-05 EP disclosed
CN-107635975-B DGAT2 inhibitors 伊莱利利公司 2020-07-24 CN disclosed
US-10647717-B2 N-sulfonylated-pyrazolo[3,4-b]pyridin-6-carboxamides and method of use ABBVIE S.Á.R.L. (LU) 2020-05-12 US disclosed
US-20190330207-A1 N-Sulfonylated-Pyrazolo[3,4-b]Pyridin-6-Carboxamides and Method of Use ABBVIE SARL (LU) 2019-10-31 US disclosed
US-20190202823-A1 N-SULFONYLATED PYRAZOLO[3,4-b]PYRIDIN-6-CARBOXAMIDES AND METHOD OF USE ABBVIE SARL (LU) 2019-07-04 US disclosed
US-5556987-A Process for producing pyrazolecarboxamide derivative FUJI PHOTO FILM CO., LTD. (JP) 1996-09-17 US disclosed
WO-1994022866-A1 PYRAZOLOQUINAZOLONE DERIVATIVES AS NEUROTROPHIC AGENTS WARNER-LAMBERT COMPANY (US) 1994-10-13 WO disclosed
US-5342942-A Pyrazoloquinazolone derivatives as neurotrophic agents WARNER-LAMBERT COMPANY (US) 1994-08-30 US disclosed
US-5252560-A Cyclic imide derivatives, compositions and use GLAXO INC. (US) 1993-10-12 US disclosed
EP-0520573-A1 Cyclic imide derivatives GLAXO INC. (US) 1992-12-30 EP disclosed
US-4737585-A Process for the preparation of sodium amoxycillin ANTIBIOTICOS S.A. (ES) 1988-04-12 US disclosed
EP-0220925-A1 A process for the preparation of sodium amoxycillin Antibioticos, S.A. (ES) 1987-05-06 EP disclosed
EP-0125276-A1 NEW CHELATE FORMING BISQUINOLINE COMPOUNDS AND PROCESSES FOR RECOVERING METALS HÖGBERG, Sverker (SE) 1984-11-21 EP disclosed
WO-1984001946-A1 NEW CHELATE FORMING BISQUINOLINE COMPOUNDS AND PROCESSES FOR RECOVERING METALS HOEGBERG SVERKER 1984-05-24 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-20240208990-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME REN, PKD1, SAV1 ALDH1A1 219/4885TSHR 988/4885MEN1 74/4885
US-20190330207-A1 N-Sulfonylated-Pyrazolo[3,4-b]Pyridin-6-Carboxamides and Method of Use CFTR, CHRM3, P2RY1 ALDH1A1 3177/4885TSHR 230/4885MEN1 2692/4885
US-20190202823-A1 N-SULFONYLATED PYRAZOLO[3,4-b]PYRIDIN-6-CARBOXAMIDES AND METHOD OF USE CFTR, P2RY1, P2RX5 ALDH1A1 3001/4885TSHR 210/4885MEN1 2496/4885
US-10647717-B2 N-sulfonylated-pyrazolo[3,4-b]pyridin-6-carboxamides and method of use CFTR, CHRM3, P2RY1 ALDH1A1 3177/4885TSHR 230/4885MEN1 2692/4885

“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.