SCHEMBL330220

SCHEMBL330220

CCOC(=O)c1cc(N)cc(C(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.60
CYP2C19 P33261 2/20 0.60
CYP2C9 P11712 1/20 0.60
CYP1A2 P05177 2/20 0.58
LMNA P02545 1/20 0.58
CYP3A4 P08684 1/20 0.58
MAOA P21397 1/20 0.58
CA12 O43570 3/20 0.55
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
CA7 P43166 3/20 0.55
CA9 Q16790 3/20 0.55
CA14 Q9ULX7 3/20 0.55
HRH3 Q9Y5N1 1/20 0.47
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
TPMT P51580 1/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.42
CYP2D6 P10635 1/20 0.42

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 SCHEMBL111188 0.98 NPC1 (0.59) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL29649183 0.96 NPC1 (0.60) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL2810136 0.93 NPC1 (0.68) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL3327442 0.91 CYP2C19 (0.70) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL7234951 0.91 CYP2C19 (0.70) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL1278720 0.89 NPC1 (0.68) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL22660964 0.89 CYP2C19 (0.68) NPC1CYP2C19CYP2C9CYP1A2LMNA
Ammonia Solution, Strong SCHEMBL28298874 0.89 CYP2C19 (0.68) NPC1CYP2C19CYP2C9CYP1A2LMNA
Hydrochloric Acid SCHEMBL9156219 0.87 NPC1 (0.66) NPC1CYP2C19CYP2C9CYP1A2LMNA
SCHEMBL264861 0.85 CYP2C19 (0.64) NPC1CYP2C19CYP2C9CYP1A2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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-113185439-B V-shaped chiral carboxylic acid ligand, preparation method and application thereof 合肥工业大学 2024-03-12 CN claimed
CN-210145613-U Purification device for preparing high-purity 5-amino dimethyl isophthalate 江西大宇医药原料有限公司 2020-03-17 CN claimed
EP-3561003-A1 A HYBRID PIGMENT, METHOD FOR PREPARATION THEREOF AND USES THEREOF Clariant Plastics & Coatings Ltd (CH) 2019-10-30 EP claimed
CN-109836348-A A kind of synthetic method of 5- (1- Buddha's warrior attendant alkyl amide) M-phthalic acid 贺州学院 2019-06-04 CN claimed
CN-109207148-A A kind of magnanimity preparation method of high yield carbon quantum dot 张宏伟 2019-01-15 CN claimed
CN-104549164-B Micropore metal organic framework materials adsorbed for methane and acetylene and store and preparation method thereof 浙江大学 2016-08-24 CN claimed
CN-104549164-A Micro-porous metal organic framework material for methane and acetylene adsorption and storage, and preparation method of micro-porous metal organic framework material UNIV ZHEJIANG 2015-04-29 CN claimed
CN-103030655-B Microporous transition-group metal organic framework material, and preparation and application methods thereof UNIV ZHEJIANG 2015-04-15 CN claimed
US-4908309-A Forming mixture of sample, buffer, and substrate, relating change in color or fluorescence to activity of the protease as the compound is hydrolyzed thereby PROTOTEK, INC. (US) 1990-03-13 US claimed
EP-0330374-A2 Method for the colorimetric determination of DPP-IV using cinnamaldehyde PROTOTEK, INC., (US) 1989-08-30 EP claimed
US-4771123-A Peptide thioneamides as selective substrates for cysteine proteases ENZYME SYSTEMS PRODUCTS, INC. (US) 1988-09-13 US 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
US-4336186-A Analytical fluorogenic substrates for proteolytic enzymes DADE INTERNATIONAL INC. 1982-06-22 US claimed
US-4275153-A Analytical fluorogenic substrates for proteolytic enzymes AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1981-06-23 US claimed