SCHEMBL7682149

SCHEMBL7682149

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

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
BCAT2 O15382 1/20 0.31
BCAT1 P54687 1/20 0.31

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
SCHEMBL2149663 0.90 BCAT2 (0.30) BCAT2BCAT1
SCHEMBL6250694 0.85 BCAT2 (0.32) BCAT2BCAT1
SCHEMBL23436187 0.84 COMT (0.33) BCAT2BCAT1
SCHEMBL8471125 0.82 BCAT1 (0.47) MAPTBCAT2BCAT1
SCHEMBL7167614 0.82 BCAT2 (0.30) BCAT2BCAT1
SCHEMBL20356681 0.81 NOTUM (0.36)
SCHEMBL31442429 0.80 GRM4 (0.32) BCAT2BCAT1
SCHEMBL7833205 0.80 MEN1 (0.41) TP53MAPT
SCHEMBL7684186 0.80 ALDH1A1 (0.35) MAPT
SCHEMBL31442537 0.78 GRM4 (0.42)

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-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
EP-0489480-A1 Uracil derivatives and herbicides containing the same as active ingredient NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-06-10 EP disclosed
US-5108998-A CARDIOTONIC THIADIAZINE DERIVATIVES HEUMANN PHARMA GMBH & CO. (DE) 1992-04-28 US disclosed
US-5084084-A Uracil and thiouracil derivatives NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-01-28 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-20020137929-A1 1 - (3-heterocyclylphenyl) isothiourea, -isourea, -guanidine and -amidine herbicidal agents IMPDH1, GANC, DDT TP53 2328/4885MAPT 3732/4885BCAT2 1658/4885

“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.