SCHEMBL5513728

SCHEMBL5513728

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.43
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41
GABRG1 Q8N1C3 2/20 0.41
GABRG3 Q99928 2/20 0.41
GABRQ Q9UN88 2/20 0.41
CYP1A2 P05177 2/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL7914664 0.83 NAALAD2 (0.42) NAALAD2GABRPGABRDGABRA1GABRB1
SCHEMBL21754481 0.82 NAALAD2 (0.38) NAALAD2GABRPGABRDGABRA1GABRB1
SCHEMBL19805240 0.81 GABRP (0.48) NAALAD2GABRPGABRDGABRA1GABRB1
SCHEMBL21052347 0.81 CYP1A2 (0.48) NAALAD2GABRPGABRDGABRA1GABRB1
SCHEMBL14342422 0.80 ALDH1A1 (0.43) ALDH1A1LMNASLC15A2TDP1
SCHEMBL27715972 0.79 NAALAD2 (0.39) NAALAD2GABRPGABRDGABRA1GABRB1
SCHEMBL13741261 0.78 ALOX15 (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1752128 0.78 NAALAD2 (0.42) NAALAD2GABRPGABRDGABRA1GABRB1
SCHEMBL23494256 0.78 TET2 (0.41)
SCHEMBL26814437 0.77 GABRP (0.42) NAALAD2GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250320174-A1 SPIN ON METAL-ORGANIC FORMULATIONS MERCK PATENTS GMBH (DE) 2025-10-16 US claimed
EP-4334252-A2 SPIN ON METAL-ORGANIC FORMULATIONS Merck Patent GmbH (DE) 2024-03-13 EP claimed
WO-2022233919-A2 SPIN ON METAL-ORGANIC FORMULATIONS MERCK PATENT GMBH (DE) 2022-11-10 WO claimed
EP-4711434-A1 REFRIGERANT CYCLE APPARATUS Daikin Industries, Ltd. (JP) 2026-03-18 EP disclosed
EP-4234293-B1 REFRIGERATION CYCLE DEVICE FOR VEHICLE DAIKIN IND LTD (JP) 2025-12-24 EP disclosed
EP-4641061-A1 OIL-WELL METAL PIPE NIPPON STEEL CORPORATION (JP) 2025-10-29 EP disclosed
US-20250320174-A1 SPIN ON METAL-ORGANIC FORMULATIONS MERCK PATENTS GMBH (DE) 2025-10-16 US disclosed
US-12441922-B2 Refrigerant-containing composition, use of same, refrigerator having same, operation method for said refrigerator, and refrigeration cycle device equipped with same DAIKIN INDUSTRIES, LTD. (JP) 2025-10-14 US disclosed
US-20250115796-A1 REFRIGERATION CYCLE APPARATUS DAIKIN INDUSTRIES, LTD. (JP) 2025-04-10 US disclosed
EP-4083174-B1 REFRIGERATION CYCLE DEVICE, REFRIGERATION MACHINE OIL AND REFRIGERANT LEAKAGE PREVENTION AGENT DAIKIN IND LTD (JP) 2025-01-22 EP disclosed
EP-3825383-B1 REFRIGERATION CYCLE DEVICE FOR VEHICLE DAIKIN IND LTD (JP) 2024-11-06 EP disclosed
CN-103865607-A REFRIGERATING MACHINE OIL AND WORKING FLUID COMPOSITION FOR REFRIGERATING MACHINES JX NIPPON OIL & ENERGY CORP 2014-06-18 CN disclosed
US-20130207024-A1 REFRIGERATING MACHINE OIL AND WORKING FLUID COMPOSITION FOR REFRIGERATING MACHINES JX NIPPON OIL & ENERGY CORPORATION (JP) 2013-08-15 US disclosed
EP-2610329-A1 REFRIGERATING MACHINE OIL AND WORKING FLUID COMPOSITION FOR REFRIGERATING MACHINES JX Nippon Oil & Energy Corporation (JP) 2013-07-03 EP disclosed
CN-103097501-A Refrigerator oil and working fluid composition for refrigerator JX NIPPON OIL & ENERGY CORP 2013-05-08 CN disclosed
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
EP-1974944-B1 Thermal transfer ink sheet, ink cartridge, coating composition for dye layer of thermal transfer ink sheet, and thermal transfer recording method FUJIFILM CORP (JP) 2009-12-02 EP disclosed
EP-0359071-A1 Fire-resistant hydraulic fluid and process of manufacture BP Chemicals Limited (GB) 1990-03-21 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 (1 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-20250320174-A1 SPIN ON METAL-ORGANIC FORMULATIONS SLC39A11, SLC39A3, SLC39A7 NAALAD2 4106/4885GABRP 1756/4885GABRD 3317/4885

“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.