SCHEMBL407477

SCHEMBL407477

O=S(=O)(NCCCc1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 1.00
TP53 P04637 1/20 0.79
GAA P10253 1/20 0.79
KDM4E B2RXH2 1/20 0.72
LMNA P02545 1/20 0.72
PKM P14618 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.72
TPSAB1 Q15661 1/20 0.66
POLB P06746 1/20 0.66
TAAR1 Q96RJ0 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
HSD17B10 Q99714 1/20 0.63
PRMT1 Q99873 1/20 0.63
KEAP1 Q14145 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
MAPK1 P28482 1/20 0.60
TBXA2R P21731 1/20 0.58

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
SCHEMBL9278806 0.95 ALDH1A1 (0.90) ALDH1A1TP53GAAKDM4ELMNA
SCHEMBL11548243 0.90 ALDH1A1 (0.81) ALDH1A1TP53GAAKDM4ELMNA
SCHEMBL13889021 0.90 ALDH1A1 (0.81) ALDH1A1TP53GAAKDM4ELMNA
SCHEMBL412302 0.89 ALDH1A1 (0.79) ALDH1A1GAAKDM4ELMNAPKM
SCHEMBL3913371 0.89 ALDH1A1 (0.79) ALDH1A1TP53GAAKDM4ELMNA
SCHEMBL1287271 0.89 ALDH1A1 (1.00) ALDH1A1TP53GAATAAR1HSD17B10
SCHEMBL1287382 0.89 TAAR1 (0.82) ALDH1A1TP53GAAKDM4ELMNA
SCHEMBL28808214 0.89 ALDH1A1 (0.79) ALDH1A1TP53GAAPOLBTAAR1
SCHEMBL4520992 0.87 ALDH1A1 (0.77) ALDH1A1TP53GAALMNASMN1; SMN2
Hydrochloric Acid SCHEMBL3517769 0.87 ALDH1A1 (0.77) ALDH1A1GAAKDM4ELMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124482-B2 C-met modulators and methods of use EXELIXIS, INC. (US) 2021-09-21 US disclosed
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE EXELIXIS, INC. 2021-08-19 US disclosed
US-20200331860-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2020-10-22 US disclosed
CN-104969406-B Electrolyte solution for electrochemical device and electrochemical device 富士胶片和光纯药株式会社 2018-11-02 CN disclosed
US-20170355678-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2017-12-14 US disclosed
US-20160185725-A1 c-Met Modulators and Method of Use EXELIXIS, INC. 2016-06-30 US disclosed
US-20150376133-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. 2015-12-31 US disclosed
US-9174947-B2 c-Met modulators and methods of use Exelixus, Inc. (US) 2015-11-03 US disclosed
CN-104969406-A Electrolyte solution for electrochemical device and electrochemical device WAKO PURE CHEM IND LTD 2015-10-07 CN disclosed
US-20140155378-A9 c-Met Modulators and Method of Use EXELIXIS, INC. (US) 2014-06-05 US disclosed
US-7579473-B2 N-(4-{[7-{[3-(diethylamino)propyl] oxy}-6-(methyloxy) quinazolin-4-yl]oxy}-3- fluorophenyl)-N'-(4- fluorophenyl) cyclopropane-1,1-dicarboxamide; for modulating protein kinase enzymatic activity for modulating cell activities such as proliferation, differentiation, programmed cell death EXELIXIS, INC. (US) 2009-08-25 US disclosed
US-20090170896-A1 c-Met modulators and methods of use EXELIXIS, INC. (US) 2009-07-02 US disclosed
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE EXELIXIS, INC (US) 2009-04-23 US disclosed
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE EXELIXIS, INC. (US) 2007-10-18 US disclosed
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE EXELIXIS, INC. (US) 2007-09-27 US disclosed
US-20070191341-A1 N-Substituted Benzene Sulfonamides ELAN PHARMACEUTICALS, INC. 2007-08-16 US disclosed
US-7208488-B2 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2007-04-24 US disclosed
US-20070054928-A1 c-Met modulators and methods of use EXELIXIS, INC. (US) 2007-03-08 US disclosed
US-20050245573-A1 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. 2005-11-03 US disclosed
US-20050165003-A1 Treating Alzheimer's Disease; 4-Chloro-N-(4-hydroxy-3-methoxy-benzyl)-N-(2-oxo-azepan-3-yl)-benzenesulfonamide for example; gamma secretase inhibitors; inhibition of beta-amyloid synthesis with minimal inhibition of Notch Signaling ELAN PHARMACEUTICALS, INC. 2005-07-28 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 (15 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-20200331860-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET ALDH1A1 2072/4885TP53 358/4885GAA 3255/4885
US-20050165003-A1 Treating Alzheimer's Disease; 4-Chloro-N-(4-hydroxy-3-methoxy-benzyl)-N-(2-oxo-azepan-3-yl)-benzenesulfonamide for example; gamma secretase inhibitors; inhibition of beta-amyloid synthesis with minimal inhibition of Notch Signaling BACE1, PSEN1, BACE2 ALDH1A1 1694/4885TP53 1452/4885GAA 746/4885
US-20070054928-A1 c-Met modulators and methods of use FLT4, FLT1, MET ALDH1A1 2072/4885TP53 358/4885GAA 3255/4885
US-20140155378-A9 c-Met Modulators and Method of Use FLT4, MET, FLT1 ALDH1A1 2578/4885TP53 648/4885GAA 3321/4885
US-20150376133-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET ALDH1A1 2072/4885TP53 358/4885GAA 3255/4885
US-20170355678-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET ALDH1A1 2072/4885TP53 358/4885GAA 3255/4885
US-20050245573-A1 N-substituted benzene sulfonamides PSEN1, PSEN2, BCHE ALDH1A1 665/4885TP53 224/4885GAA 1320/4885
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE FLT4, FLT1, MET ALDH1A1 2072/4885TP53 358/4885GAA 3255/4885
US-20070191341-A1 N-Substituted Benzene Sulfonamides PSEN1, PSEN2, BACE1 ALDH1A1 897/4885TP53 282/4885GAA 1658/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 ALDH1A1 2597/4885TP53 545/4885GAA 3321/4885
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 ALDH1A1 2578/4885TP53 648/4885GAA 3321/4885
US-20160185725-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 ALDH1A1 2578/4885TP53 648/4885GAA 3321/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 ALDH1A1 2578/4885TP53 648/4885GAA 3321/4885
US-11124482-B2 C-met modulators and methods of use FLT4, FLT1, MET ALDH1A1 2072/4885TP53 358/4885GAA 3255/4885
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE FLT4, MET, FLT1 ALDH1A1 2597/4885TP53 545/4885GAA 3321/4885

“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.