SCHEMBL3169103

SCHEMBL3169103

Cc1ccc(-n2nc(C(C)(C)C)cc2OC(=O)NCC(Cl)(Cl)Cl)cc1OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.40
MAPK12 P53778 6/20 0.40
MAPK13 O15264 3/20 0.40
MAPK11 Q15759 3/20 0.40
JAK2 O60674 1/20 0.39
HCK P08631 3/20 0.38
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
SRC P12931 1/20 0.36
NOTUM Q6P988 1/20 0.36
PTGER1 P34995 2/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL3173927 0.86 CDK8 (0.41) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3187950 0.81 CDK8 (0.50) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3169111 0.81 MAPK14 (0.50) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3179866 0.81 CDK8 (0.39) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3188140 0.79 CDK8 (0.40) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3179274 0.79 CDK8 (0.43) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3190573 0.78 MAPK14 (0.45) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL4420313 0.77 MAPK14 (0.48) MAPK14MAPK13JAK2
SCHEMBL3176393 0.77 MAPK14 (0.51) MAPK14MAPK12MAPK13MAPK11JAK2
SCHEMBL3187903 0.77 MAPK14 (0.48) MAPK14MAPK12MAPK13MAPK11JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016319-A1 ARYLMETHYLENE UREA DERIVATIVE AND USE THEREOF TORAY INDUSTRIES, INC. A CORPORATION OF JAPAN (JP) 2010-01-21 US disclosed
EP-1970375-A1 ARYLMETHYLENE UREA DERIVATIVE AND USE THEREOF TORAY INDUSTRIES, INC. (JP) 2008-09-17 EP 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 (1 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-20100016319-A1 ARYLMETHYLENE UREA DERIVATIVE AND USE THEREOF UROD, UTS2R, SLC14A1 MAPK14 500/4885MAPK12 1129/4885MAPK13 593/4885

“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.