SCHEMBL3177792

SCHEMBL3177792

Cc1coc(NC(=O)NCc2ccccc2Oc2ccnc(Cl)n2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.58
ANO1 Q5XXA6 2/20 0.40
MAPK1 P28482 4/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
GAA P10253 2/20 0.37
ALOX15 P16050 2/20 0.37
HSD17B10 Q99714 2/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2C9 P11712 1/20 0.36
NAMPT P43490 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
SCHEMBL3175136 0.83 MAPK14 (0.65) MAPK14GAAUSP2ALDH1A1CYP2C9
SCHEMBL3169145 0.81 MAPK14 (0.57) MAPK14ANO1MAPK1ROCK2ROCK1
SCHEMBL3174314 0.79 KEAP1 (0.51) MAPK14MAPK1KMT2AHSD17B10USP2
SCHEMBL3168891 0.77 MAPK14 (0.62) MAPK14ANO1MAPK1ROCK2ROCK1
SCHEMBL3182478 0.76 MAPK14 (0.47) MAPK14ANO1ROCK2ROCK1MEN1
SCHEMBL3176072 0.75 MAPK14 (0.58) MAPK14ANO1ROCK2ROCK1NPC1
SCHEMBL3180046 0.74 MAPK14 (1.00) MAPK14
SCHEMBL3183389 0.74 MAPK14 (0.61) MAPK14ANO1MAPK1ROCK2ROCK1
SCHEMBL3185429 0.73 MAPK14 (0.91) MAPK14
SCHEMBL3184222 0.73 MAPK14 (0.85) MAPK14

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 4 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
US-20100016319-A1 ARYLMETHYLENE UREA DERIVATIVE AND USE THEREOF TORAY INDUSTRIES, INC. A CORPORATION OF JAPAN (JP) 2010-01-21 US disclosed
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 500/4885ANO1 3096/4885MAPK1 1355/4885

“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.