SCHEMBL4401762

SCHEMBL4401762

CCCCOc1ccc(NC(=O)C(=O)OCC)cc1F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.57
S1PR4 O95977 1/20 0.49
S1PR1 P21453 1/20 0.49
S1PR3 Q99500 1/20 0.49
S1PR5 Q9H228 1/20 0.49
ALDH1A1 P00352 2/20 0.48
FFAR1 O14842 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HSD17B10 Q99714 1/20 0.44
FAAH O00519 2/20 0.44
HPGD P15428 2/20 0.43
NPC1 O15118 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL12164847 0.86 S1PR4 (0.52) MAPTS1PR4S1PR1S1PR3S1PR5
SCHEMBL29693563 0.82 ALDH1A1 (0.67) MAPTALDH1A1FFAR1KDM4EGAA
SCHEMBL371996 0.82 ALDH1A1 (0.67) MAPTALDH1A1FFAR1KDM4EGAA
SCHEMBL9885402 0.79 S1PR1 (0.58) MAPTS1PR4S1PR1S1PR3S1PR5
SCHEMBL4656709 0.78 MAPT (0.64) MAPTS1PR4S1PR1S1PR3S1PR5
SCHEMBL30890031 0.78 MAPT (0.64) MAPTALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL3036107 0.78 MAPT (0.64) MAPTALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL5371922 0.76 ALDH1A1 (0.62) MAPTS1PR1S1PR3ALDH1A1GAA
SCHEMBL4403551 0.76 POLB (0.62) MAPTS1PR4S1PR1S1PR3S1PR5
SCHEMBL38657860 0.75 MAPT (0.61) MAPTALDH1A1SMN1; SMN2KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20140155396-A1 C-Met Modulators and Method of Use EXELIXIS, INC. 2014-06-05 US disclosed
US-20140155378-A9 c-Met Modulators and Method of Use EXELIXIS, INC. (US) 2014-06-05 US disclosed
EP-2392565-B1 c-Met modulators and methods of use EXELIXIS INC (US) 2014-03-19 EP disclosed
US-20130252940-A1 c-Met Modulators and Method of Use EXELIXIS, INC. (US) 2013-09-26 US disclosed
US-8497284-B2 C-met modulators and method of use EXELIXIS, INC. (US) 2013-07-30 US disclosed
US-8476298-B2 c-Met modulators and method of use EXELIXIS, INC. (US) 2013-07-02 US disclosed
US-8067436-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) 2011-11-29 US disclosed
EP-2210607-B1 N-[3-fluoro-4-({6-(methyloxy)-7-[(3-morpholin-4-ylpropyl)oxy]quinolin-4-yl}oxy)phenyl]-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide for the treatment of cancer EXELIXIS INC (US) 2011-08-17 EP disclosed
US-20110077233-A1 C-Met Modulators and Method of Use EXELIXIS, INC. (US) 2011-03-31 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-20080161305-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. (US) 2008-07-03 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-20070054928-A1 c-Met modulators and methods of use EXELIXIS, INC. (US) 2007-03-08 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 (13 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-20070054928-A1 c-Met modulators and methods of use FLT4, FLT1, MET MAPT 4161/4885S1PR4 1903/4885S1PR1 2625/4885
US-20140155378-A9 c-Met Modulators and Method of Use FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885
US-20140155396-A1 C-Met Modulators and Method of Use FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885
US-20150376133-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET MAPT 4161/4885S1PR4 1903/4885S1PR1 2625/4885
US-20170355678-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET MAPT 4161/4885S1PR4 1903/4885S1PR1 2625/4885
US-20080161305-A1 C-Met Modulators and Methods of Use MET, HGFAC, HGF MAPT 4168/4885S1PR4 2534/4885S1PR1 2643/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 MAPT 4108/4885S1PR4 1798/4885S1PR1 2372/4885
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885
US-20160185725-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE FLT4, MET, FLT1 MAPT 4108/4885S1PR4 1798/4885S1PR1 2372/4885
US-20130252940-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885
US-20110077233-A1 C-Met Modulators and Method of Use FLT4, MET, FLT1 MAPT 4118/4885S1PR4 1768/4885S1PR1 2336/4885

“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.