SCHEMBL467994

SCHEMBL467994

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

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.61
CTSS P25774 3/20 0.61
CA2 P00918 2/20 0.53
CA1 P00915 1/20 0.53
CA7 P43166 1/20 0.53
PREP P48147 1/20 0.49
TRPA1 O75762 2/20 0.48
CTSL P07711 2/20 0.48
CTSB P07858 2/20 0.48
CYP2D6 P10635 1/20 0.47
TSHR P16473 2/20 0.45
APP P05067 1/20 0.44
KMT2A Q03164 2/20 0.44
SDCBP O00560 1/20 0.43
SDC2 P34741 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 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
SCHEMBL29674710 1.00 CTSK (0.61) CTSKCTSSCA2CA1CA7
SCHEMBL59323 1.00 CTSK (0.61) CTSKCTSSCA2CA1CA7
SCHEMBL256794 1.00 CTSK (0.61) CTSKCTSSCA2CA1CA7
SCHEMBL28058549 0.98 CTSK (0.59) CTSKCTSSCA2CA1CA7
Ammonia Solution, Strong SCHEMBL28313812 0.98 CTSK (0.59) CTSKCTSSCA2CA1CA7
Fluoride SCHEMBL7360444 0.98 CTSK (0.59) CTSKCTSSCA2CA1CA7
Fluoride SCHEMBL7360449 0.98 CTSK (0.59) CTSKCTSSCA2CA1CA7
SCHEMBL22371979 0.93 CTSK (0.63) CTSKCTSSCA2CA1CA7
SCHEMBL7345607 0.93 CTSK (0.63) CTSKCTSSCA2CA1CA7
SCHEMBL22371977 0.93 CTSK (0.63) CTSKCTSSCA2CA1CA7

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

Appears in 2106 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116270255-B High-adhesion composite sodium hyaluronate repair patch and preparation method thereof 哈尔滨运美达生物科技有限公司 2024-10-18 CN claimed
CN-114409714-B Method for synthesizing 1, 3-disubstituted plane chiral metallocene compound 武汉大学 2024-02-06 CN claimed
CN-116270255-A High-adhesion composite sodium hyaluronate repair patch and preparation method thereof 哈尔滨运美达生物科技有限公司 2023-06-23 CN claimed
EP-3394057-B1 SYNTHETIC METHOD FOR PREPARATION OF (S)-(2R,3R,11BR)-3-ISOBUTYL-9,10-DIMETHOXY-2,3,4,6,7,11B-HEXAHYDRO-1H-PYRIDO[2,1,-A]LSOQUINOLIN-2-YL 2-AMINO-3-METHYLBUTANOATE DI(4-METHYLBENZENESULFONATE) NEUROCRINE BIOSCIENCES INC (US) 2022-03-30 EP claimed
CN-113164765-A Thrombin inhibitors, formulations and uses thereof 维颂国际公司 2021-07-23 CN claimed
CN-109553633-A A kind of preparation method of phenylacetic acid type aryne 湖北大学 2019-04-02 CN claimed
CN-105273023-B A kind of preparation method of 5 '-O-L- valinate hydrochlorides of cytarabine 昆明积大制药股份有限公司 2018-11-06 CN claimed
US-10000520-B2 B-vitamin and amino acid conjugates ofnicotinoyl ribosides and reduced nicotinoyl ribosides, derivatives thereof, and methods of preparation thereof ChromaDex Inc. (US) 2018-06-19 US claimed
EP-3050563-B1 ESTER PRO-DRUGS OF [3-(1-(1H-IMIDAZOL-4-YL)ETHYL)-2-METHYLPHENYL] METHANOL FOR TREATING SKIN DISEASES AND CONDITIONS ALLERGAN INC (US) 2018-05-09 EP claimed
US-20170267709-A1 B-VITAMIN AND AMINO ACID CONJUGATES OFNICOTINOYL RIBOSIDES AND REDUCED NICOTINOYL RIBOSIDES, DERIVATIVES THEREOF, AND METHODS OF PREPARATION THEREOF ChromaDex Inc. (US) 2017-09-21 US claimed
WO-2003041647-A2 SYNTHESIS AND PURIFICATION OF VALACYCLOVIR TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2003-05-22 WO claimed
US-6398857-B1 ACCUSTIC PIEZOELECTRIC; HOT MELT INK JET PRINTING; BENZOIC ACID VEHICLE; ALKYL OR PHENYL CARBOXYLIC ACID VISCOSITY MODIFIER; RETAINS DESIRED HARDNESS XEROX CORPORATION 2002-06-04 US claimed
US-6395077-B1 INKS WITH BENZOYLBENZOIC ACID AND COLORS XEROX CORPORATION 2002-05-28 US claimed
US-5757408-A PRINTING IMAGE ON SUBSTRATE COATED WITH AMINO-ACID DERIVATIVE ADDITIVE; QUICK DRYING OF INK, OPTICAL DENSITY, NONCURLING XEROX CORPORATION (US) 1998-05-26 US claimed
US-5683793-A Ink jet transparencies XEROX CORPORATION (US) 1997-11-04 US claimed
US-5589277-A INK JET PRINTING, AQUEOUS INKS, FAST DRYING XEROX CORPORATION (US) 1996-12-31 US claimed
EP-0667246-A1 Recording sheets containing amino acids, hydroxy acids, and polycarboxyl compounds XEROX CORPORATION (US) 1995-08-16 EP claimed
EP-0204775-A4 AMINO ACID AND PEPTIDE INHIBITORS OF HUMAN LEUCOCYTIC ELASTASE. UNIV TROBE (AU) 1989-10-04 EP claimed
EP-0204775-A1 AMINO ACID AND PEPTIDE INHIBITORS OF HUMAN LEUCOCYTIC ELASTASE AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED (AU) 1986-12-17 EP claimed
WO-1986003746-A1 AMINO ACID AND PEPTIDE INHIBITORS OF HUMAN LEUCOCYTIC ELASTASE LA TROBE UNIVERSITY (AU) 1986-07-03 WO claimed