SCHEMBL4401161

SCHEMBL4401161

Cc1ccc(NC(=O)C(=O)N2CCc3ccccc3C2)cc1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.76
NPC1 O15118 10/20 0.76
SMN1; SMN2 Q16637 4/20 0.76
TAS1R3 Q7RTX0 2/20 0.76
TAS1R1 Q7RTX1 2/20 0.76
TAS1R2 Q8TE23 2/20 0.76
ALDH1A1 P00352 1/20 0.76
NAMPT P43490 2/20 0.63
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
TP53 P04637 1/20 0.58
MAPK1 P28482 1/20 0.57
GAA P10253 1/20 0.56
MAPT P10636 2/20 0.56
ATM Q13315 1/20 0.56
USP2 O75604 1/20 0.56
TAAR1 Q96RJ0 1/20 0.56
HPGD P15428 1/20 0.54
NOTUM Q6P988 1/20 0.54

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
SCHEMBL5522728 0.86 RAB9A (1.00) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL4398186 0.80 NOTUM (0.63) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL703044 0.78 NAMPT (1.00) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL13884527 0.76 NOTUM (0.58) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL13211911 0.76 HTT (0.71) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL4405065 0.75 SMN1; SMN2 (0.72) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL30515325 0.74 RAB9A (1.00) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL10226339 0.74 RAB9A (1.00) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL4398359 0.74 SMN1; SMN2 (0.64) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL3708277 0.72 RAB9A (1.00) RAB9ANPC1SMN1; SMN2TAS1R3TAS1R1

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 3070/4885NPC1 3618/4885SMN1; SMN2 4421/4885
US-20080161305-A1 C-Met Modulators and Methods of Use MET, HGFAC, HGF RAB9A 3398/4885NPC1 3103/4885SMN1; SMN2 4127/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 RAB9A 3215/4885NPC1 3278/4885SMN1; SMN2 4679/4885
US-20070225307-A1 C-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 RAB9A 3263/4885NPC1 3357/4885SMN1; SMN2 4701/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 RAB9A 3263/4885NPC1 3357/4885SMN1; SMN2 4701/4885
US-20090105299-A1 c-MET MODULATORS AND METHODS OF USE FLT4, MET, FLT1 RAB9A 3215/4885NPC1 3278/4885SMN1; SMN2 4679/4885

“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.