SCHEMBL813445

SCHEMBL813445

C/C=C(/C(=O)O)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL1058467 1.00 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL8565714 1.00 ALDH1A1 (0.35) ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL5178346 0.97 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL5461417 0.77 TSHR (0.32) ALDH1A1TSHR
SCHEMBL2378001 0.77 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL1965967 0.77 TSHR (0.33) ALDH1A1TSHR
SCHEMBL3630555 0.77 TSHR (0.33) ALDH1A1TSHR
Hydrogen Peroxide SCHEMBL28392769 0.77 TSHR (0.33) ALDH1A1TSHR
SCHEMBL1965963 0.77 TSHR (0.33) ALDH1A1TSHR
SCHEMBL5468780 0.77 TSHR (0.38) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067644-B2 Process for conducting an organic reaction in ionic liquids THE PROCTER & GAMBLE COMPANY (US) 2011-11-29 US claimed
EP-2370387-A2 PROCESS FOR CONDUCTING AN ORGANIC REACTION IN IONIC LIQUIDS The Procter & Gamble Company (US) 2011-10-05 EP claimed
US-20110152566-A1 Process for Conducting an Organic Reaction in Ionic Liquids THE PROCTER & GAMBLE COMPANY 2011-06-23 US claimed
US-12110525-B2 Method for enzymatic preparation of R-3 aminobutyric acid Abiochem Biotechnology (Group) Co., Ltd. (CN) 2024-10-08 US disclosed
EP-4234551-A2 PYRIDAZINONES AS PARP7 INHIBITORS Ribon Therapeutics Inc. (US) 2023-08-30 EP disclosed
EP-3788040-B1 PYRIDAZINONES AS PARP7 INHIBITORS RIBON THERAPEUTICS INC (US) 2023-04-12 EP disclosed
US-11566020-B1 Pyridazinones as PARP7 inhibitors RIBON THERAPEUTICS, INC. (US) 2023-01-31 US disclosed
US-20220090152-A1 METHOD FOR ENZYMATIC PREPARATION OF R-3 AMINOBUTYRIC ACID ABIOCHEM BIOTECHNOLOGY CO., LTD. (CN) 2022-03-24 US disclosed
US-11220701-B2 Method for enzymatic preparation of R-3 aminobutyric acid ABIOCHEM BIOTECHNOLOGY CO., LTD. (CN) 2022-01-11 US disclosed
EP-3788040-A1 PYRIDAZINONES AS PARP7 INHIBITORS Ribon Therapeutics Inc. (US) 2021-03-10 EP disclosed
US-20200232002-A1 METHOD FOR ENZYMATIC PREPARATION OF R-3 AMINOBUTYRIC ACID ABIOCHEM BIOTECHNOLOGY CO., LTD. (CN) 2020-07-23 US disclosed
EP-3680340-A1 METHOD FOR ENZYMATIC PREPARATION OF R-3-AMINOBUTYRIC ACID Abiochem Biotechnology Co., Ltd. (CN) 2020-07-15 EP disclosed
US-8067644-B2 Process for conducting an organic reaction in ionic liquids THE PROCTER & GAMBLE COMPANY (US) 2011-11-29 US disclosed
EP-2370387-A2 PROCESS FOR CONDUCTING AN ORGANIC REACTION IN IONIC LIQUIDS The Procter & Gamble Company (US) 2011-10-05 EP disclosed
US-20110152566-A1 Process for Conducting an Organic Reaction in Ionic Liquids THE PROCTER & GAMBLE COMPANY 2011-06-23 US disclosed
EP-1227111-A1 TRIPHENYLBORON-CONTAINING POLYMERS AND USE THEREOF Yoshitomi Fine Chemicals, Ltd. (JP) 2002-07-31 EP disclosed
EP-0711147-A1 SUSPENSIONS FOR DELIVERY OF MEDICAMENT INSITE VISION INCORPORATED (US) 1996-05-15 EP disclosed
WO-1995003784-A1 SUSPENSIONS FOR DELIVERY OF MEDICAMENT INSITE VISION INCORPORATED (US) 1995-02-09 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-20110152566-A1 Process for Conducting an Organic Reaction in Ionic Liquids ACSL3, ACSL1, MCOLN1 ALDH1A1 142/4885TSHR 3361/4885
US-11566020-B1 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 ALDH1A1 1033/4885TSHR 3587/4885

“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.