SCHEMBL2754136

SCHEMBL2754136

CN(c1ccccc1)C(C(N)=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
NR1H3 Q13133 2/20 0.38
MLYCD O95822 1/20 0.38
POLQ O75417 1/20 0.38
TACR1 P25103 2/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALOX5 P09917 1/20 0.35
NR1H2 P55055 1/20 0.35
SCN9A Q15858 1/20 0.34

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
SCHEMBL6828600 0.84 MLYCD (0.38) SLC6A2SLC6A4NR1H3MLYCDPOLQ
SCHEMBL2754132 0.79 NR1H2 (0.45) NR1H3ALDH1A1SMN1; SMN2TP53KMT2A
SCHEMBL1818385 0.77 ALDH1A1 (0.46) SLC6A2SLC6A4ALDH1A1SMN1; SMN2LMNA
SCHEMBL8586520 0.74 ALOX5 (0.43) SLC6A2SLC6A4ALDH1A1SMN1; SMN2LMNA
SCHEMBL1821413 0.74 ALOX5 (0.43) SLC6A2SLC6A4ALDH1A1SMN1; SMN2LMNA
SCHEMBL11760439 0.73 SLC6A2 (0.45) SLC6A2SLC6A4ALDH1A1SMN1; SMN2LMNA
SCHEMBL1821353 0.73 SLC6A2 (0.45) SLC6A2SLC6A4ALDH1A1SMN1; SMN2LMNA
Carbamic Acid SCHEMBL27977071 0.72 ALDH1A1 (0.46) SLC6A2SLC6A4MLYCDALDH1A1SMN1; SMN2
SCHEMBL31467993 0.71 SLC6A2 (0.44) SLC6A2SLC6A4ALDH1A1SMN1; SMN2LMNA
SCHEMBL3211903 0.68 SLC6A2 (0.59) SLC6A2SLC6A4ALOX5

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 20 patents. 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
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
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-20120184523-A1 C-Met Modulators and Method of Use EXELIXIS, INC. (US) 2012-07-19 US disclosed
US-8178532-B2 c-Met modulators and method of use EXELIXIS, INC. (US) 2012-05-15 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-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 (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 SLC6A2 3028/4885SLC6A4 1181/4885NR1H3 3168/4885
US-20070054928-A1 c-Met modulators and methods of use FLT4, FLT1, MET SLC6A2 3028/4885SLC6A4 1181/4885NR1H3 3168/4885
US-20140155378-A9 c-Met Modulators and Method of Use FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885
US-20140155396-A1 C-Met Modulators and Method of Use FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885
US-20150376133-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET SLC6A2 3028/4885SLC6A4 1181/4885NR1H3 3168/4885
US-20170355678-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET SLC6A2 3028/4885SLC6A4 1181/4885NR1H3 3168/4885
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE FLT4, FLT1, MET SLC6A2 3028/4885SLC6A4 1181/4885NR1H3 3168/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 SLC6A2 3477/4885SLC6A4 1634/4885NR1H3 3516/4885
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885
US-20160185725-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885
US-11124482-B2 C-met modulators and methods of use FLT4, FLT1, MET SLC6A2 3028/4885SLC6A4 1181/4885NR1H3 3168/4885
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE FLT4, MET, FLT1 SLC6A2 3477/4885SLC6A4 1634/4885NR1H3 3516/4885
US-20120184523-A1 C-Met Modulators and Method of Use FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885
US-20130252940-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 SLC6A2 3458/4885SLC6A4 1625/4885NR1H3 3553/4885

“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.