SCHEMBL4405065

SCHEMBL4405065

Cc1ccc(NC(=O)C(=O)N2CCCCC2)cc1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.72
GAA P10253 4/20 0.72
LMNA P02545 4/20 0.72
RAB9A P51151 9/20 0.71
NPC1 O15118 8/20 0.71
KDM4E B2RXH2 2/20 0.58
KMT2A Q03164 5/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
NPSR1 Q6W5P4 1/20 0.53
MEN1 O00255 3/20 0.53
MAPT P10636 3/20 0.53
POLB P06746 2/20 0.53
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
MCL1 Q07820 1/20 0.50

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
SCHEMBL9662172 0.83 RAB9A (0.60) SMN1; SMN2GAALMNARAB9ANPC1
SCHEMBL8363751 0.83 RAB9A (1.00) SMN1; SMN2GAARAB9ANPC1KMT2A
SCHEMBL6037506 0.81 RAB9A (0.96) SMN1; SMN2RAB9ANPC1KMT2AL3MBTL1
SCHEMBL12139494 0.80 RAB9A (0.97) SMN1; SMN2GAALMNARAB9ANPC1
SCHEMBL12139525 0.76 SMN1; SMN2 (0.72) SMN1; SMN2GAALMNARAB9ANPC1
SCHEMBL6850999 0.75 KDM4E (0.79) SMN1; SMN2RAB9ANPC1KDM4EKMT2A
SCHEMBL16383844 0.75 GAA (0.70) SMN1; SMN2GAALMNARAB9ANPC1
SCHEMBL4401161 0.75 RAB9A (0.76) SMN1; SMN2GAARAB9ANPC1KMT2A
SCHEMBL4577738 0.74 GRIN2D (0.80) SMN1; SMN2LMNAKDM4EKMT2AL3MBTL1
SCHEMBL11485841 0.74 RAB9A (0.62) SMN1; SMN2GAALMNARAB9ANPC1

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 SMN1; SMN2 4421/4885GAA 3255/4885LMNA 2924/4885
US-20080161305-A1 C-Met Modulators and Methods of Use MET, HGFAC, HGF SMN1; SMN2 4127/4885GAA 3610/4885LMNA 3678/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 SMN1; SMN2 4679/4885GAA 3321/4885LMNA 3245/4885
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 SMN1; SMN2 4701/4885GAA 3321/4885LMNA 3308/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 SMN1; SMN2 4701/4885GAA 3321/4885LMNA 3308/4885
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE FLT4, MET, FLT1 SMN1; SMN2 4679/4885GAA 3321/4885LMNA 3245/4885

“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.