SCHEMBL111187

SCHEMBL111187

COC(=O)c1cc(N)cc(C(=O)OC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA7 P43166 3/20 0.58
CA9 Q16790 3/20 0.58
CA14 Q9ULX7 3/20 0.58
KDM4E B2RXH2 5/20 0.56
GAA P10253 4/20 0.56
POLB P06746 2/20 0.56
XDH P47989 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
LMNA P02545 2/20 0.56
NFKB1 P19838 1/20 0.56
GFER P55789 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
FUT7 Q11130 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ATAD2 Q6PL18 1/20 0.53
ALDH1A1 P00352 2/20 0.52

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
Hydrochloric Acid SCHEMBL111186 0.98 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL654773 0.95 CA1 (0.58) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL9494959 0.93 CA1 (0.56) CA12CA1CA2CA7CA9
SCHEMBL2205901 0.92 KDM4E (0.50) CA12CA1CA2CA7CA9
SCHEMBL4731090 0.92 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL10600019 0.92 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL28312240 0.90 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL8410461 0.89 ATAD2 (0.60) CA12CA1CA2CA7CA9
SCHEMBL15827366 0.88 ATAD2 (0.49) CA12CA1CA2CA7CA9
SCHEMBL2367491 0.88 CA12 (0.47) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115616056-B Photoelectrochemical aptamer sensor and preparation method and application thereof 温州医科大学 2025-04-25 CN claimed
CN-119121440-A PTT fiber with low acrolein content and preparation method therefor 江苏恒科新材料有限公司 2024-12-13 CN claimed
CN-119102004-A Modified polyester filament and preparation method thereof 江苏恒科新材料有限公司 2024-12-10 CN claimed
CN-118993927-A Synthesis method of 5-acetamido-2, 4, 6-triiodo-N, N' -bis (2, 3-dihydroxypropyl) -1, 3-benzenedicarboxamide 浙江海洲制药股份有限公司 2024-11-22 CN claimed
CN-118978691-A Block polymer for cathode catalytic layer, cathode catalytic layer slurry, membrane electrode and preparation method 上海空间电源研究所 2024-11-19 CN claimed
CN-118955882-A Method for preparing regenerated polyester chips by using waste polyester cloth and regenerated polyester chips 汕头市通艺织造业有限公司 2024-11-15 CN claimed
CN-118213551-A Preparation method of phosphoric acid type covalent organic framework doped sulfonated polyether-ether-ketone proton exchange membrane 天津大学 2024-06-18 CN claimed
CN-118026868-A 5-Dimethyl amino isophthalate and tetracyanobenzene eutectic compound and preparation method and application thereof 天津大学 2024-05-14 CN claimed
CN-118005848-A Flame-retardant polypropylene plastic and preparation method thereof 深圳市光亚新材料有限公司 2024-05-10 CN claimed
CN-113185439-B V-shaped chiral carboxylic acid ligand, preparation method and application thereof 合肥工业大学 2024-03-12 CN claimed
US-4480030-A BLOOD-COAGULATION FACTOR XA PENTAPHARM A.G. (CH) 1984-10-30 US claimed
US-4440678-A ARGININES PENTAPHARM, A.G. (CH) 1984-04-03 US claimed
EP-0034122-B1 TRIPEPTIDE DERIVATIVES AND THEIR USE IN THE DETERMINATION OF ENZYMES Pentapharm A.G. (CH) 1983-09-21 EP claimed
EP-0078764-A1 Process for the quantitative determination of the blood clotting factor XII in human plasma Pentapharm A.G. (CH) 1983-05-11 EP claimed
US-4336186-A Analytical fluorogenic substrates for proteolytic enzymes DADE INTERNATIONAL INC. 1982-06-22 US claimed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US claimed
WO-1981002294-A1 TRIPEPTIDIC DERIVATIVES AND USE THEREOF FOR ENZYME DETERMINATION PENTAPHARM AG (CH) 1981-08-20 WO claimed
EP-0034122-A1 Tripeptide derivatives and their use in the determination of enzymes Pentapharm A.G. (CH) 1981-08-19 EP claimed
US-4275153-A Analytical fluorogenic substrates for proteolytic enzymes AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1981-06-23 US claimed
US-4167449-A Composition and method for determining transferase and protease activity AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1979-09-11 US claimed