SCHEMBL4401153

SCHEMBL4401153

Cc1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.73
ALDH1A1 P00352 9/20 0.71
MAPT P10636 4/20 0.71
POLB P06746 2/20 0.71
TDP1 Q9NUW8 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
ALOX12 P18054 2/20 0.67
HTT P42858 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
GAA P10253 5/20 0.66
LMNA P02545 1/20 0.64
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MAPK1 P28482 1/20 0.63
CRHBP P24387 1/20 0.61
NPBWR1 P48145 1/20 0.61
CRHR2 Q13324 1/20 0.61
MCHR1 Q99705 1/20 0.61
KDM4E B2RXH2 1/20 0.57
XBP1 P17861 1/20 0.57

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
SCHEMBL14096326 0.86 ALDH1A1 (0.74) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL1871517 0.85 RAB9A (0.69) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL14096629 0.85 RAB9A (0.69) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL14096626 0.85 RAB9A (1.00) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL257816 0.84 EPHX2 (0.76) RAB9AALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL10243034 0.81 ALDH1A1 (0.62) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL18606697 0.81 CA1 (0.75) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL14096016 0.79 MAPT (0.74) RAB9AALDH1A1MAPTTDP1ALOX12
SCHEMBL5450295 0.79 LMNA (0.76) RAB9AALDH1A1MAPTPOLBTDP1
SCHEMBL15840545 0.79 ALDH1A1 (0.69) RAB9AALDH1A1MAPTPOLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174947-B2 c-Met modulators and methods of use Exelixus, Inc. (US) 2015-11-03 US disclosed
US-8178532-B2 c-Met modulators and method of use EXELIXIS, INC. (US) 2012-05-15 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
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 (6 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 RAB9A 3070/4885ALDH1A1 2072/4885MAPT 4161/4885
US-20080161305-A1 C-Met Modulators and Methods of Use MET, HGFAC, HGF RAB9A 3398/4885ALDH1A1 2327/4885MAPT 4168/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 RAB9A 3215/4885ALDH1A1 2597/4885MAPT 4108/4885
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 RAB9A 3263/4885ALDH1A1 2578/4885MAPT 4118/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 RAB9A 3263/4885ALDH1A1 2578/4885MAPT 4118/4885
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE FLT4, MET, FLT1 RAB9A 3215/4885ALDH1A1 2597/4885MAPT 4108/4885

“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.