SCHEMBL14550467

SCHEMBL14550467

[2H]C([2H])([2H])NC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C)c3)cc2)ccn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 13/20 0.66
KDR P35968 6/20 0.66
RET P07949 4/20 0.66
MAPK14 Q16539 4/20 0.66
EPHX2 P34913 4/20 0.66
AURKB Q96GD4 3/20 0.66
ABL1 P00519 3/20 0.66
EPHA2 P29317 3/20 0.66
MAP3K20 Q9NYL2 3/20 0.66
BRAF P15056 3/20 0.66
PLK4 O00444 2/20 0.66
AURKA O14965 2/20 0.66
MAPK13 O15264 2/20 0.66
MAP4K4 O95819 2/20 0.66
LCK P06239 2/20 0.66
FYN P06241 2/20 0.66
LYN P07948 2/20 0.66
SRC P12931 2/20 0.66
RPS6KB1 P23443 2/20 0.66
AXL P30530 2/20 0.66

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
SCHEMBL14481171 0.95 RAF1 (0.65) RAF1KDRRETMAPK14EPHX2
SCHEMBL10324287 0.93 RAF1 (0.75) RAF1KDRRETMAPK14EPHX2
SCHEMBL14481178 0.90 RAF1 (0.71) RAF1KDRRETMAPK14EPHX2
SCHEMBL14751419 0.90 KDR (0.70) RAF1KDRRETMAPK14EPHX2
SCHEMBL13946016 0.87 RAF1 (0.61) RAF1KDRRETMAPK14EPHX2
Cm-4307 SCHEMBL14480690 0.87 RAF1 (0.88) RAF1KDRRETMAPK14EPHX2
Cm-4307 SCHEMBL29362075 0.87 RAF1 (0.88) RAF1KDRRETMAPK14EPHX2
Cm-4307 SCHEMBL30172564 0.87 RAF1 (0.88) RAF1KDRRETMAPK14EPHX2
SCHEMBL14680564 0.86 RAF1 (0.60) RAF1KDRRETMAPK14EPHX2
SCHEMBL17547702 0.86 RAF1 (0.63) RAF1KDRRETMAPK14EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140088311-A1 METHOD FOR PREPARING DEUTERATED DIPHENYLUREA SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2014-03-27 US disclosed
US-8669369-B2 Method and process for preparation and production of deuterated Ω-diphenylurea SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2014-03-11 US disclosed
US-20130060044-A1 METHOD FOR PREPARING DEUTERATED DIPHENYLUREA SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2013-03-07 US disclosed
US-20130035492-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. 2013-02-07 US disclosed
US-20130018209-A1 PREPARATION METHODS OF METHYL-D3-AMINE AND SALTS THEREOF SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2013-01-17 US disclosed
US-20130012548-A1 DEUTERIUM-SUBSTITUTED OMEGA-DIPHENYLUREA AND DERIVATIVES THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUNDS SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2013-01-10 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 (5 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-20140088311-A1 METHOD FOR PREPARING DEUTERATED DIPHENYLUREA NMUR1, NMUR2, NUDT1 RAF1 4326/4885KDR 4744/4885RET 3322/4885
US-20130012548-A1 DEUTERIUM-SUBSTITUTED OMEGA-DIPHENYLUREA AND DERIVATIVES THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUNDS PPARD, HDHD5, SCD RAF1 2908/4885KDR 1916/4885RET 2868/4885
US-20130035492-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA PNLIP, PDXK, PNP RAF1 1962/4885KDR 3367/4885RET 3120/4885
US-20130018209-A1 PREPARATION METHODS OF METHYL-D3-AMINE AND SALTS THEREOF NSD3, CCND3, DRD3 RAF1 4408/4885KDR 4053/4885RET 2176/4885
US-20130060044-A1 METHOD FOR PREPARING DEUTERATED DIPHENYLUREA NMUR1, NMUR2, NUDT1 RAF1 4326/4885KDR 4744/4885RET 3322/4885

“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.