SCHEMBL3349953

SCHEMBL3349953

CC(C)(C)OC(=O)NC(CO)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.60
CTSK P43235 4/20 0.56
CTSS P25774 3/20 0.56
GPR88 Q9GZN0 3/20 0.50
MAPT P10636 1/20 0.49
ATM Q13315 1/20 0.49
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
GABRB1 P18505 1/20 0.46
GABRB2 P47870 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46

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
SCHEMBL2481921 1.00 RIPK1 (0.60) RIPK1CTSKCTSSGPR88MAPT
SCHEMBL127326 1.00 RIPK1 (0.60) RIPK1CTSKCTSSGPR88MAPT
SCHEMBL2701580 0.94 RIPK1 (0.55) RIPK1CTSKCTSSGPR88MAPT
SCHEMBL14831426 0.91 CTSK (0.52) RIPK1CTSKCTSSGPR88ATM
SCHEMBL14831425 0.91 CTSK (0.52) RIPK1CTSKCTSSGPR88ATM
SCHEMBL21349963 0.89 GPR88 (0.53) RIPK1CTSKCTSSGPR88
SCHEMBL56698 0.88 CTSK (0.53) RIPK1CTSKCTSSMAPTATM
SCHEMBL4353938 0.88 CTSK (0.53) RIPK1CTSKCTSSMAPTATM
SCHEMBL56596 0.88 CTSK (0.53) RIPK1CTSKCTSSMAPTATM
SCHEMBL5020954 0.88 CTSK (0.52) RIPK1CTSKCTSSMAPTCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114641468-B Process for synthesizing ELAGOLIX sodium salt and intermediate of said process 工业化学有限公司 2024-11-12 CN claimed
US-11840519-B2 Process for the synthesis of the sodium salt of 4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)-phenyl]methyl]-3,6-dihydro-4-methyl-2.6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]-butanoic acid (elagolix sodium salt) and intermediates of said process INDUSTRIALE CHIMICA S.R.L. (IT) 2023-12-12 US claimed
US-20220281829-A1 PROCESS FOR THE SYNTHESIS OF THE SODIUM SALT OF 4-[[(1R)-2-[5-(2-FLUORO-3-METHOXYPHENYL)-3-[[2-FLUORO-6-(TRIFLUOROMETHYL)-PHENYL]METHYL]-3,6-DIHYDRO-4-METHYL-2,6- DIOXO-1(2H)-PYRIMIDINYL]-1- PHENYLETHYL]AMINO]-BUTANOIC ACID (ELAGOLIX SODIUM SALT) AND INTERMEDIATES OF SAID PROCESS INDUSTRIALE CHIMCA S.R.L. (IT) 2022-09-08 US claimed
CN-114641468-A Process for the synthesis of the sodium salt of 4- [ [ (1R) -2- [5- (2-fluoro-3-methoxyphenyl) -3- [ [ 2-fluoro-6- (trifluoromethyl) -phenyl ] methyl ] -3, 6-dihydro-4-methyl-2, 6-dioxo-1 (2H) -pyrimidinyl ] -1-phenylethyl ] amino ] -butyric acid (ELAGOLIX sodium salt) and intermediates of said process 工业化学有限公司 2022-06-17 CN claimed
US-8338617-B2 Process for preparing oxazolidine derivatives DR. REDDY'S LABORATORIES LIMITED (IN) 2012-12-25 US claimed
US-20090131679-A1 PROCESS FOR PREPARING OXAZOLIDINE DERIVATIVES DR. REDDY'S LABORATORIES, INC. 2009-05-21 US claimed
US-12612414-B2 Nitrile SUMO inhibitors and uses thereof CIT THERAPEUTICS, INC. (US) 2026-04-28 US disclosed
WO-2025124599-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF SUZHOU KEEN THERAPEUTICS CO., LTD. (CN) 2025-06-19 WO disclosed
US-20250084042-A1 Elagolix Sodium Compositions and Processes ABBVIE INC. 2025-03-13 US disclosed
US-20250034120-A1 PYRIDAZINONES AS PARP7 INHIBITORS RIBON THERAPEUTICS, INC. 2025-01-30 US disclosed
US-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES Clear Creek Bio, Inc. (US) 2025-01-23 US disclosed
CN-114641468-B Process for synthesizing ELAGOLIX sodium salt and intermediate of said process 工业化学有限公司 2024-11-12 CN disclosed
US-20240360148-A1 NITRILE SUMO INHIBITORS AND USES THEREOF CIT THERAPEUTICS LLC 2024-10-31 US disclosed
US-5280027-A Quinazoline containing compound IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-18 US disclosed
EP-0365045-B1 Perhydrothiazepine derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1993-12-01 EP disclosed
EP-0459730-A2 Anti-tumour compounds ZENECA LIMITED (GB) 1991-12-04 EP disclosed
EP-0161801-B1 PERHYDROTHIAZEPINE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANKYO COMPANY LIMITED (JP) 1990-11-07 EP disclosed
EP-0365045-A1 Perhydrothiazepine derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1990-04-25 EP disclosed
US-4699905-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1987-10-13 US disclosed
EP-0161801-A2 Perhydrothiazepine derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1985-11-21 EP 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 (8 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-20250034120-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 RIPK1 728/4885CTSK 1145/4885CTSS 2478/4885
US-20090131679-A1 PROCESS FOR PREPARING OXAZOLIDINE DERIVATIVES CYP4X1, CDK19, CDK9 RIPK1 4683/4885CTSK 4486/4885CTSS 4684/4885
US-20240360148-A1 NITRILE SUMO INHIBITORS AND USES THEREOF SUMO1, SUMO3, SUMO2 RIPK1 1402/4885CTSK 2620/4885CTSS 1554/4885
US-20250084042-A1 Elagolix Sodium Compositions and Processes ELOVL5, ELOC, ELOVL3 RIPK1 3893/4885CTSK 2635/4885CTSS 3505/4885
US-12612414-B2 Nitrile SUMO inhibitors and uses thereof SUMO1, SUMO3, PSMB6 RIPK1 2996/4885CTSK 2087/4885CTSS 1281/4885
US-11840519-B2 Process for the synthesis of the sodium salt of 4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)-phenyl]methyl]-3,6-dihydro-4-methyl-2.6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]-butanoic acid (elagolix sodium salt) and intermediates of said process ELP1, BPNT1, EPX RIPK1 4818/4885CTSK 4856/4885CTSS 4858/4885
US-20220281829-A1 PROCESS FOR THE SYNTHESIS OF THE SODIUM SALT OF 4-[[(1R)-2-[5-(2-FLUORO-3-METHOXYPHENYL)-3-[[2-FLUORO-6-(TRIFLUOROMETHYL)-PHENYL]METHYL]-3,6-DIHYDRO-4-METHYL-2,6- DIOXO-1(2H)-PYRIMIDINYL]-1- PHENYLETHYL]AMINO]-BUTANOIC ACID (ELAGOLIX SODIUM SALT) AND INTERMEDIATES OF SAID PROCESS ELP1, BPNT1, EPX RIPK1 4816/4885CTSK 4854/4885CTSS 4858/4885
US-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES ACE, PREP, PEPD RIPK1 801/4885CTSK 93/4885CTSS 39/4885

“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.