SCHEMBL2953240

SCHEMBL2953240

CN(CCO)CCOC(=O)N(c1ccc(C(F)(F)F)cc1)c1nccc(-c2cccc(Cl)c2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.38
▸ SCN9A Q15858 1/20 0.37
▸ SLC6A9 P48067 2/20 0.36
▸ LIPE Q05469 1/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ CCND3 P30281 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ CNR2 P34972 4/20 0.34
▸ TRPV1 Q8NER1 2/20 0.34
▸ SLC6A7 Q99884 1/20 0.34
▸ NOD1 Q9Y239 2/20 0.33
▸ NOD2 Q9HC29 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ IGF1R P08069 1/20 0.33
▸ GPBAR1 Q8TDU6 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PDE4B Q07343 1/20 0.33

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
SCHEMBL30332807 1.00 KMO (0.38) KMOSCN9ASLC6A9LIPECDK4
SCHEMBL14003560 0.92 KMO (0.41) KMOSLC6A9LIPECDK4CCND3
SCHEMBL14028801 0.89 KMO (0.41) KMOLIPECDK4CCND3GSK3B
SCHEMBL14003561 0.88 KDM4E (0.40) KMOSCN9ALIPECDK4CCND3
SCHEMBL14028843 0.86 KMO (0.42) KMOLIPECDK4CCND3GSK3B
SCHEMBL14028798 0.86 KMO (0.43) KMOLIPECDK4CCND3GSK3B
SCHEMBL14003570 0.86 KMO (0.39) KMOSCN9ACDK4CCND3GSK3B
SCHEMBL14028842 0.85 KMO (0.41) KMOLIPECDK4CCND3GSK3B
SCHEMBL3138575 0.85 KMO (0.38) KMOCDK4TRPV1NOD1NOD2
SCHEMBL14003548 0.84 KMO (0.39) KMOLIPECDK4CCND3GSK3B

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230152314-A1 LIPOCALIN-2 ASSAY FOR INTESTINAL ADAPTATION THE JOHNS HOPKINS UNIVERSITY 2023-05-18 — — US disclosed
US-20230095683-A1 COPROCOCCUS BACTERIA FOR USE IN THE TREATMENT OF METABOLIC SYNDROME AND INFLAMMATORY BOWEL DISEASES SORBONNE UNIVERSITE (FR) 2023-03-30 — — US disclosed
US-11596657-B2 Use of AhR agonist for the preventive or curative treatment of metabolic syndrome and the associated disorders INSTITUT NATIONAL DE LA RECHERCHE AGRONOMIQUE (FR) 2023-03-07 — — US disclosed
EP-4114420-A1 COPROCOCCUS BACTERIA FOR USE IN THE TREATMENT OF METABOLIC SYNDROME AND INFLAMMATORY BOWEL DISEASES Institut national de recherche pour l'agriculture, l'alimentation et l'environnement (FR) 2023-01-11 — — EP disclosed
WO-2021175998-A1 COPROCOCCUS BACTERIA FOR USE IN THE TREATMENT OF METABOLIC SYNDROME AND INFLAMMATORY BOWEL DISEASES INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2021-09-10 — — WO disclosed
EP-3875098-A1 USE OF COPROCOCCUS BACTERIA FOR THE TREATMENT OF METABOLIC SYNDROME AND INFLAMMATORY BOWEL DISEASES INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2021-09-08 — — EP disclosed
US-20190282638-A1 USE OF AHR AGONIST FOR THE PREVENTIVE OR CURATIVE TREATMENT OF METABOLIC SYNDROME AND THE ASSOCIATED DISORDERS INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2019-09-19 — — US disclosed
EP-3522902-A1 USE OF AHR AGONIST FOR THE PREVENTIVE OR CURATIVE TREATMENT OF METABOLIC SYNDROME AND THE ASSOCIATED DISORDERS Institut National de la Recherche Agronomique (FR) 2019-08-14 — — EP disclosed
WO-2018065132-A1 USE OF AHR AGONIST FOR THE PREVENTIVE OR CURATIVE TREATMENT OF METABOLIC SYNDROME AND THE ASSOCIATED DISORDERS. INSTITUT NATIONAL DE LA RECHERCHE AGRONOMIQUE (FR) 2018-04-12 — — WO disclosed
US-9757378-B2 Methods to modulate acute myeloid leukemia stem/progenitor cell expansion and/or differentiation UNIVERSITE DE MONTREAL (CA) 2017-09-12 — — US disclosed
US-20140343051-A1 METHODS TO MODULATE ACUTE MYELOID LEUKEMIA STEM/PROGENITOR CELL EXPANSION AND/OR DIFFERENTIATION HOPITAL MAISONNEUVE-ROSEMONT (CA) 2014-11-20 — — US disclosed
US-7759357-B2 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2010-07-20 — — US disclosed
US-20080279829-A1 Phenyl-(4-Phenyl-Pyrimidin-2-Yl)-Amines For Enhancing Immunotolerance WOISETSCHLAEGER MAXIMILIAN 2008-11-13 — — US disclosed
US-20080279829-A1 Phenyl-(4-Phenyl-Pyrimidin-2-Yl)-Amines For Enhancing Immunotolerance WOISETSCHLAEGER MAXIMILIAN 2008-11-13 — — US disclosed
EP-1474146-B1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS NOVARTIS AG (CH) 2008-08-27 — — EP disclosed
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2007-12-06 — — US disclosed
US-20050119255-A1 Phenylpyrimidine amines as ige inhibitors BULUSU MURTY (AT) 2005-06-02 — — US disclosed
EP-1474146-A1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS Novartis AG (CH) 2004-11-10 — — EP disclosed
WO-2003063871-A1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS NOVARTIS AG (CH) 2003-08-07 — — WO 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 (4 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-20080279829-A1 Phenyl-(4-Phenyl-Pyrimidin-2-Yl)-Amines For Enhancing Immunotolerance IFNG, IL2, LY96 KMO 716/4885SCN9A 4188/4885SLC6A9 4399/4885
US-20140343051-A1 METHODS TO MODULATE ACUTE MYELOID LEUKEMIA STEM/PROGENITOR CELL EXPANSION AND/OR DIFFERENTIATION MCL1, AHR, MYADM KMO 185/4885SCN9A 4318/4885SLC6A9 4695/4885
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors FCER2, SELP, FCGR2A KMO 2307/4885SCN9A 3610/4885SLC6A9 4691/4885
US-20050119255-A1 Phenylpyrimidine amines as ige inhibitors FCER2, SELP, FCGR2A KMO 2307/4885SCN9A 3610/4885SLC6A9 4691/4885

“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.

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