SCHEMBL2838744

SCHEMBL2838744

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(-c3nc4ccccc4s3)c(Cl)cc2Cl)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.46
GHSR Q92847 2/20 0.39
HCAR1 Q9BXC0 2/20 0.39
ALDH1A1 P00352 8/20 0.38
MAPT P10636 7/20 0.38
SMN1; SMN2 Q16637 7/20 0.38
KDM4E B2RXH2 6/20 0.38
GAA P10253 6/20 0.38
HPGD P15428 5/20 0.38
S1PR2 O95136 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
GLA P06280 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HCRTR1 O43613 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
RAB9A P51151 5/20 0.36
NPC1 O15118 4/20 0.36
CYP1A2 P05177 2/20 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
SCHEMBL2839506 0.93 THRB (0.42) THRBGHSRHCAR1ALDH1A1MAPT
SCHEMBL2835569 0.86 THRB (0.41) THRBALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL2841428 0.74 SHMT1 (0.32)
SCHEMBL2838234 0.72 KDM4E (0.39) THRBALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL2838087 0.72 AGPAT2 (0.41) THRBALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL6250694 0.72 BCAT2 (0.32)
SCHEMBL2836086 0.72 PDK2 (0.33)
SCHEMBL2837974 0.72 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL23436187 0.71 COMT (0.33) HPGD
SCHEMBL7682149 0.71 TP53 (0.35) MAPTTP53

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-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 US claimed
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US disclosed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 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 (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-20060025591-A1 New uracils having a herbicidal activity UNG, DDT, UMPS THRB 2839/4885GHSR 3049/4885HCAR1 2898/4885

“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.