SCHEMBL1360237

SCHEMBL1360237

CC(C)(C)c1cccc(C(=O)Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.62
HDAC8 Q9BY41 4/20 0.50
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
HDAC4 P56524 1/20 0.48
HDAC2 Q92769 1/20 0.48
NR1H4 Q96RI1 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
CES2 O00748 1/20 0.46
HDAC3 O15379 1/20 0.45
CYP26A1 O43174 1/20 0.44
CYP26B1 Q9NR63 1/20 0.44
KCNK9 Q9NPC2 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
P2RX1 P51575 1/20 0.40
NPSR1 Q6W5P4 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
SCHEMBL29540544 1.00 ACHE (0.62) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL8774976 0.88 ACHE (0.49) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL27811835 0.82 ALDH1A1 (0.44) ACHEALDH1A1TSHRCES2KCNK9
SCHEMBL7771557 0.82 ACHE (0.65) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL309330 0.82 ACHE (0.65) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL2173132 0.82 ACHE (0.65) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL179538 0.82 RXRA (0.66) ACHEHDAC8RXRARXRBHDAC6
SCHEMBL4861345 0.82 TSHR (0.47) ACHEALDH1A1TSHRCES2P2RX1
Ethane SCHEMBL27364386 0.81 CES2 (0.67) ALDH1A1CES2KCNK9MEN1KMT2A
SCHEMBL827199 0.80 BRAF (0.46) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010796-A Small molecule inhibitor based on lactate dehydrogenase targeting design and application thereof 南京师范大学 2026-05-12 CN disclosed
US-12590098-B2 Pyrimido pyrimidinone compound and pharmaceutical composition comprising the same AXCESO BIOPHARMA CO., LTD. (KR) 2026-03-31 US disclosed
EP-4215533-B1 PYRIMIDOPYRIMIDINONE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AXCESO BIOPHARMA CO LTD (KR) 2026-02-11 EP disclosed
US-20250243161-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2025-07-31 US disclosed
US-12269800-B2 Delivery of therapeutic alkaloid compounds SENSORIUM THERAPEUTICS, INC. (US) 2025-04-08 US disclosed
US-20250051277-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2025-02-13 US disclosed
US-20240246910-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2024-07-25 US disclosed
US-11999694-B2 Delivery of therapeutic alkaloid compounds SENSORIUM THERAPEUTICS, INC. (US) 2024-06-04 US disclosed
US-20230348474-A1 PYRIMIDO PYRIMIDINONE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AXCESO BIOPHARMA CO., LTD. (KR) 2023-11-02 US disclosed
EP-4215533-A1 PYRIMIDOPYRIMIDINONE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Axceso Biopharma Co., Ltd. (KR) 2023-07-26 EP disclosed
US-20060128776-A1 Opioid receptor active compounds THE CURATORS OF THE UNIVERSITY OF MISSOURI 2006-06-15 US disclosed
US-7045520-B2 Opioid receptor active compounds THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2006-05-16 US disclosed
EP-1485088-A1 OPIOID RECEPTOR ACTIVE 4-(3-HYDROXYPHENYL) OR 4-(3-ALKOXYPHENYL)-1,2,4-TRIAZOLE COMPOUNDS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2004-12-15 EP disclosed
US-20030225072-A1 Opioid receptor active compounds CURATORS OF THE UNIVERSITY OF MISSOURI, THE 2003-12-04 US disclosed
WO-2003066050-A1 OPIOID RECEPTOR ACTIVE 4-(3-HYDROXYPHENYL) OR 4-(3-ALKOXYPHENYL)-1,2,4-TRIAZOLE COMPOUNDS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2003-08-14 WO disclosed
EP-0659738-B1 N-(Carbonyl, carbonimidoyl, carbonothioyl) sulfonamide charge control agents and toners and developers EASTMAN KODAK CO (US) 1997-09-10 EP disclosed
US-5616797-A USED IN ELECTROPHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1997-04-01 US disclosed
EP-0659738-A1 N-(Carbonyl, carbonimidoyl, carbonothioyl) sulfonamide charge control agents and toners and developers EASTMAN KODAK COMPANY (US) 1995-06-28 EP disclosed
US-5405727-A Electrophotography EASTMAN KODAK COMPANY (US) 1995-04-11 US disclosed
US-5397798-A Benzamide and sulfonamide hypoglycemic agents ELI LILLY AND COMPANY (US) 1995-03-14 US 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 (9 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-20030225072-A1 Opioid receptor active compounds OPRL1, OPRM1, OPRK1 ACHE 876/4885HDAC8 2536/4885RXRA 406/4885
US-20250051277-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS PNMT, HNMT, NNMT ACHE 37/4885HDAC8 2225/4885RXRA 4547/4885
US-20250243161-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS PNMT, HNMT, NNMT ACHE 37/4885HDAC8 2225/4885RXRA 4547/4885
US-20240246910-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS PNMT, HNMT, NNMT ACHE 37/4885HDAC8 2225/4885RXRA 4547/4885
US-20230348474-A1 PYRIMIDO PYRIMIDINONE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME PDCD1, PDCD1LG2, CD274 ACHE 4640/4885HDAC8 1211/4885RXRA 1329/4885
US-20060128776-A1 Opioid receptor active compounds OPRL1, OPRM1, OPRK1 ACHE 513/4885HDAC8 2607/4885RXRA 338/4885
US-12269800-B2 Delivery of therapeutic alkaloid compounds PNMT, HNMT, NNMT ACHE 37/4885HDAC8 2225/4885RXRA 4547/4885
US-11999694-B2 Delivery of therapeutic alkaloid compounds PNMT, HNMT, NNMT ACHE 37/4885HDAC8 2225/4885RXRA 4547/4885
US-12590098-B2 Pyrimido pyrimidinone compound and pharmaceutical composition comprising the same PDCD1, CD274, PDCD1LG2 ACHE 4810/4885HDAC8 419/4885RXRA 1164/4885

“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.