SCHEMBL7286165

SCHEMBL7286165

CC(C)[C@@H](N)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.68
F2 P00734 1/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2C P18825 1/20 0.52
LMNA P02545 1/20 0.52
HIF1A Q16665 1/20 0.52
KDM4E B2RXH2 1/20 0.52
TAAR1 Q96RJ0 3/20 0.50
ALDH1A1 P00352 1/20 0.50
AOC3 Q16853 2/20 0.46

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
SCHEMBL522687 1.00 DPP4 (0.68) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL1980156 1.00 DPP4 (0.68) DPP4F2ADRA2AADRA2CLMNA
Hydrochloric Acid SCHEMBL22713306 0.97 DPP4 (0.65) DPP4F2ADRA2AADRA2CLMNA
Hydrochloric Acid SCHEMBL3753145 0.97 DPP4 (0.65) DPP4F2ADRA2AADRA2CLMNA
Bromide SCHEMBL11538603 0.97 DPP4 (0.65) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL3271282 0.85 DPP4 (0.45) DPP4ADRA2AADRA2CLMNAHIF1A
SCHEMBL20634768 0.84 DPP4 (0.62) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL77070 0.83 DPP4 (0.68) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL10506371 0.83 DPP4 (0.68) DPP4F2ADRA2AADRA2CLMNA
SCHEMBL3367415 0.83 DPP4 (0.68) DPP4F2ADRA2AADRA2CLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195459-B Process for racemization of (5R) -4- [5- (3, 5-dichlorophenyl) -5- (trifluoromethyl) -4H isoxazol-3-yl ] -2-methyl-benzoic acid 英特维特国际股份有限公司 2024-11-01 CN disclosed
CN-113242854-B Preparation method of (5S) -4- [5- (3, 5-dichlorophenyl) -5- (trifluoromethyl) -4H-isoxazol-3-yl ] -2-methylbenzoic acid 英特维特国际股份有限公司 2024-09-24 CN disclosed
EP-3898598-B1 METHOD FOR PRODUCING (5S)-4-[5-(3,5-DICHLOROPHENYL)-5-(TRIFLUOROMETHYL)-4H-ISOXAZOL-3-YL]-2-METHYL-BENZOIC ACID INTERVET INT BV (NL) 2024-09-11 EP disclosed
CN-113227060-B Preparation method of (5S) -4- [5- (3, 5-dichlorophenyl) -5- (trifluoromethyl) -4H-isoxazol-3-yl ] -2-methylbenzoic acid 英特维特国际股份有限公司 2024-09-06 CN disclosed
US-11548859-B2 Method for producing (5,S)-4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4Hisoxazol-3-yl]-2-methyl-benzoic acid INTERVET INC. (US) 2023-01-10 US disclosed
US-11548859-B2 Method for producing (5,S)-4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4Hisoxazol-3-yl]-2-methyl-benzoic acid INTERVET INC. (US) 2023-01-10 US disclosed
US-11530187-B2 Method for producing (5S)-4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4H-isoxazol-3-yl]-2-methyl-benzoic acid INTERVET INC. (US) 2022-12-20 US disclosed
US-11530187-B2 Method for producing (5S)-4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4H-isoxazol-3-yl]-2-methyl-benzoic acid INTERVET INC. (US) 2022-12-20 US disclosed
US-11371067-B2 Transaminase reactions CODEXIS, INC. (US) 2022-06-28 US disclosed
US-20220073479-A1 Method for Producing (5,S)-4-[5-(3,5-Dichlorophenyl)-5-(Trifluoromethyl)-4Hisoxazol-3-YL]-2-Methyl-Benzoic Acid INTERVET INC. (US) 2022-03-10 US disclosed
US-20070264230-A1 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands SCHERING CORPORATION 2007-11-15 US disclosed
EP-1818325-A2 3,4-DI-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION (US) 2007-08-15 EP disclosed
EP-1381590-B1 3,4-DI-SUBSTITUTED CYCLOBUTENE-1,2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS SCHERING CORP (US) 2007-06-20 EP disclosed
US-20070021494-A1 3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION AND PHARMACOPEIA, INC. 2007-01-25 US disclosed
US-20070021494-A1 3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION AND PHARMACOPEIA, INC. 2007-01-25 US disclosed
US-5696134-A Irreversible HIV protease inhibitors, intermediates, compositions and processes for the preparation thereof LG CHEMICAL LIMITED (KR) 1997-12-09 US disclosed
EP-0779296-A2 D-alpha-aminoalkanoyl-(S)-N-alpha-alkylbenzyl amides useful as intermediates for artificial sweeteners THE COCA-COLA COMPANY (US) 1997-06-18 EP disclosed
EP-0687675-A2 Irreversible HIV protease inhibitors, intermediates, compositions and processes for the preparation thereof LG Chemical Limited (KR) 1995-12-20 EP disclosed
WO-1995017418-A2 NOVEL INTERMEDIATES FOR THE SYNTHESIS OF L-ASPARTYL-D-α-AMINOALKANOYL-(S)-N-α-ALKYLBENZYL AMIDES USEFUL AS ARTIFICIAL SWEETENERS THE COCA-COLA COMPANY (US) 1995-06-29 WO disclosed
US-5286509-A L-aspartyl-D-α-aminoalkanoyl-(S)-N-alpha-alkylbenzyl amides useful as artificial sweeteners THE COCA-COLA COMPANY (US) 1994-02-15 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 (5 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-11530187-B2 Method for producing (5S)-4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4H-isoxazol-3-yl]-2-methyl-benzoic acid GABRA5, KDM5A, COX5A DPP4 599/4885F2 1895/4885ADRA2A 1256/4885
US-20070021494-A1 3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands CCR1, ACKR3, CXCR1 DPP4 2687/4885F2 1379/4885ADRA2A 1532/4885
US-20070264230-A1 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands CXCR1, CCR2, CX3CR1 DPP4 2617/4885F2 840/4885ADRA2A 1127/4885
US-20220073479-A1 Method for Producing (5,S)-4-[5-(3,5-Dichlorophenyl)-5-(Trifluoromethyl)-4Hisoxazol-3-YL]-2-Methyl-Benzoic Acid KDM5A, GABRA5, KDM5B DPP4 838/4885F2 1283/4885ADRA2A 1161/4885
US-11548859-B2 Method for producing (5,S)-4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4Hisoxazol-3-yl]-2-methyl-benzoic acid GABRA5, KDM5A, KDM5B DPP4 728/4885F2 1526/4885ADRA2A 1046/4885

“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.