SCHEMBL7682453

SCHEMBL7682453

CC(=O)Nc1cc(-n2c(=O)cc(C(F)(F)F)[nH]c2=O)c(F)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 17/20 0.50
BCAT2 O15382 15/20 0.50
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL9423008 0.83 BCAT1 (0.53) BCAT1BCAT2
SCHEMBL9123594 0.81 BCAT1 (0.48) BCAT1BCAT2
SCHEMBL10532221 0.80 BCAT1 (0.56) BCAT1BCAT2MEN1KMT2A
SCHEMBL5393246 0.80 BCAT1 (0.54) BCAT1BCAT2
SCHEMBL22720000 0.79 BCAT1 (0.51) BCAT1BCAT2
SCHEMBL3321881 0.79 BCAT1 (0.51) BCAT1BCAT2
SCHEMBL29574910 0.78 BCAT1 (0.55) BCAT1BCAT2
SCHEMBL9879060 0.78 BCAT1 (0.50) BCAT1BCAT2
SCHEMBL22720001 0.78 BCAT1 (0.51) BCAT1BCAT2
SCHEMBL7687900 0.78 KMT2A (0.36) MEN1KMT2A

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-20020137929-A1 1 - (3-heterocyclylphenyl) isothiourea, -isourea, -guanidine and -amidine herbicidal agents INTELLECTUAL PROPERTY DEPARTMENT, BASF AKTIENGESELLSCHAFT (DE) 2002-09-26 US disclosed
US-6303783-B1 1- (3-Heterocyclylphenyl) isothiourea, -isourea, -guanidine and -amidine herbicidal agents AMERICAN CYANAMID CO. 2001-10-16 US disclosed
EP-0985670-A1 1-(3-Heterocyclylphenyl)isothiourea, -isourea, -guanidine and -amidine compounds as herbicides American Cyanamid Company (US) 2000-03-15 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-20020137929-A1 1 - (3-heterocyclylphenyl) isothiourea, -isourea, -guanidine and -amidine herbicidal agents IMPDH1, GANC, DDT BCAT1 1438/4885BCAT2 1658/4885MEN1 3680/4885

“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.