SCHEMBL8737306

SCHEMBL8737306

CCCNC(=O)c1cccc(Oc2ccc(C)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 1/20 0.56
RAF1 P04049 1/20 0.56
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
GCK P35557 1/20 0.54
NR1H2 P55055 1/20 0.53
NR1H3 Q13133 1/20 0.53
MAPK14 Q16539 1/20 0.53
ALDH1A1 P00352 4/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HDAC8 Q9BY41 1/20 0.51
DRD2 P14416 1/20 0.50
DRD4 P21917 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
SCHEMBL14336245 0.90 ALDH1A1 (0.64) L3MBTL1SMN1; SMN2RAF1GAAMAPT
SCHEMBL8736963 0.89 MMP13 (0.56) MMP13SMN1; SMN2HPGDRAF1GCK
SCHEMBL8737464 0.88 SMN1; SMN2 (0.61) MMP13SMN1; SMN2HPGDRAF1GAA
SCHEMBL6014130 0.84 RAF1 (0.61) MMP13SMN1; SMN2HPGDRAF1GCK
SCHEMBL10163507 0.82 MMP13 (0.56) MMP13L3MBTL1SMN1; SMN2RAF1MAPT
SCHEMBL8738321 0.82 MAPK14 (0.76) MMP13SMN1; SMN2HPGDRAF1MAPK14
SCHEMBL6361446 0.81 GAA (0.73) MMP13L3MBTL1SMN1; SMN2HPGDGAA
SCHEMBL257694 0.81 MMP13 (0.71) MMP13SMN1; SMN2HPGDRAF1GCK
SCHEMBL8737039 0.81 DRD4 (0.64) L3MBTL1RAF1LMNAPOLBKMT2A
SCHEMBL6014104 0.81 SMN1; SMN2 (0.51) MMP13SMN1; SMN2HPGDGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120129893-A1 Inhibition Of Raf Kinase Using Substituted Heterocyclic Ureas DUMAS JACQUES (US) 2012-05-24 US disclosed
US-20080032979-A1 Omega-Carboxyaryl Substituted Diphenyl Ureas As Raf Kinease Inhibitors BAYER HEALTHCARE LLC 2008-02-07 US disclosed
US-20070244120-A1 INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS BAYER HEALTHCARE LLC 2007-10-18 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 (3 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-20080032979-A1 Omega-Carboxyaryl Substituted Diphenyl Ureas As Raf Kinease Inhibitors BRAF, NRAS, RAF1 MMP13 1139/4885L3MBTL1 3860/4885SMN1; SMN2 3882/4885
US-20070244120-A1 INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS BRAF, RAF1, ARAF MMP13 4028/4885L3MBTL1 1879/4885SMN1; SMN2 4560/4885
US-20120129893-A1 Inhibition Of Raf Kinase Using Substituted Heterocyclic Ureas BRAF, RAF1, ARAF MMP13 4028/4885L3MBTL1 1879/4885SMN1; SMN2 4560/4885

“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.