SCHEMBL3728188

SCHEMBL3728188

CN(C)S(=O)(=O)c1ccc2[nH]cnc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
TNNI3K Q59H18 1/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
PKM P14618 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MMP12 P39900 1/20 0.39
VCAM1 P19320 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR6 P50406 1/20 0.39
PRKCI P41743 1/20 0.39
CYP3A4 P08684 1/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL14323389 0.84 KDM4E (0.40) ALDH1A1MAPTKDM4EPKMTDP1
SCHEMBL1266021 0.81 MMP12 (0.42) ALDH1A1MAPTKDM4ETDP1MMP12
SCHEMBL11783635 0.79 JAK2 (0.41) TNNI3KMAPTKDM4EMMP12PRKCI
SCHEMBL362000 0.78 POLB (0.50) ALDH1A1MAPTKDM4ETDP1LMNA
Potassium Ion SCHEMBL2918768 0.78 PRKCI (0.42) ALDH1A1MAPTKDM4EPKMTDP1
SCHEMBL27786197 0.78 PRKCI (0.42) ALDH1A1MAPTKDM4EPKMTDP1
SCHEMBL571363 0.78 PRKCI (0.42) ALDH1A1MAPTKDM4ETDP1HTT
SCHEMBL4429284 0.78 PRKCI (0.42) ALDH1A1MAPTKDM4ETDP1HTT
SCHEMBL31647242 0.77 TAS2R14 (0.51) TNNI3KHTTLMNASMN1; SMN2HTR6
SCHEMBL28975737 0.77 HDAC6 (0.41) ALDH1A1MAPTKDM4ETDP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140303182-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES NOVARTIS AG (CH) 2014-10-09 US disclosed
US-20130338171-A1 Pharmaceutically Acceptable Salts of Quinolinone Compounds Having Improved Pharmaceutical Properties NOVARTIS AG (CH) 2013-12-19 US disclosed
US-20130018058-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES CAI SHAOPEI (US) 2013-01-17 US disclosed
CN-1976706-B FGFR3 inhibition and treatment of multiple myeloma NOVARTIS VACCINES & DIAGNOSTIC 2012-01-18 CN disclosed
CN-1960731-B Method for regulating inflammatory and metastatic processes NOVARTIS VACCINES AND DIAGNOSTICS INC. (US) 2011-12-07 CN disclosed
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 US disclosed
CN-100526312-C Benzimidazole quinolinones and uses thereof CHIRON CORP (US) 2009-08-12 CN disclosed
US-20090181979-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-07-16 US disclosed
EP-1497287-A4 QUINOLINONE DERIVATIVES NOVARTIS VACCINES & DIAGNOSTIC (US) 2007-07-11 EP disclosed
CN-1976706-A FGFR3 inhibition and treatment of multiple myeloma CHIRON CORP (US) 2007-06-06 CN disclosed
CN-1960731-A Method for regulating inflammatory and metastatic processes CHIRON CORP (US) 2007-05-09 CN disclosed
CN-1692112-A Benzimidazole quinolinones and uses thereof CHIRON CORP (US) 2005-11-02 CN disclosed
US-20050209247-A1 Lactate salt of 4-amino-5-fluoro-3-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]quinolin-2(1H)-one; improved water solubility and physicochemical properties (e.g., stability, hygroscopicity, crystallinity, and compactibility); vascular endothelial growth factor receptor tyrosine kinase inhibitors CHIRON CORPORATION 2005-09-22 US disclosed
CN-1659165-A Quinolinone derivatives CHIRON CORP (US) 2005-08-24 CN disclosed
EP-1497287-A1 QUINOLINONE DERIVATIVES CHIRON CORPORATION (US) 2005-01-19 EP disclosed
WO-2003087095-A1 QUINOLINONE DERIVATIVES CHIRON CORPORATION (US) 2003-10-23 WO disclosed
CN-1226283-A Recombinant enzyme with dextranase activity NOVO NORDISK AS (DK) 1999-08-18 CN disclosed
EP-0055428-B1 BIS-(3-SULFOPROPYL)ETHERS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ALKYLATING AGENTS FOR ORGANIC BASES Agfa-Gevaert AG (DE) 1984-03-14 EP 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-20130338171-A1 Pharmaceutically Acceptable Salts of Quinolinone Compounds Having Improved Pharmaceutical Properties H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RAB14, SLC13A3 ALDH1A1 1479/4885HTR2C 1306/4885HTR2B 1894/4885
US-20090181979-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RAB14, SLC13A3 ALDH1A1 1479/4885HTR2C 1306/4885HTR2B 1894/4885
US-20050209247-A1 Lactate salt of 4-amino-5-fluoro-3-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]quinolin-2(1H)-one; improved water solubility and physicochemical properties (e.g., stability, hygroscopicity, crystallinity, and compactibility); vascular endothelial growth factor receptor tyrosine kinase inhibitors KDR, FLT4, FLT1 ALDH1A1 1023/4885HTR2C 1559/4885HTR2B 1688/4885
US-20140303182-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RAB14, SLC13A3 ALDH1A1 1479/4885HTR2C 1306/4885HTR2B 1894/4885
US-20130018058-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RAB14, SLC13A3 ALDH1A1 1479/4885HTR2C 1306/4885HTR2B 1894/4885

“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.