SCHEMBL7690667

SCHEMBL7690667

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(/N=C3\SCC(=O)N3Cc3ccc(F)cc3)c(Cl)cc2F)c1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 3/20 0.34
CA9 Q16790 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KCNN4 O15554 4/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC5A1 P13866 1/20 0.33
SLC5A2 P31639 1/20 0.33
TP53 P04637 2/20 0.33
MAPK1 P28482 1/20 0.32
OPRK1 P41145 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL7690669 1.00 MAPT (0.39) MAPTTSHRL3MBTL1ALDH1A1CA9
SCHEMBL7684744 0.95 MAPT (0.39) MAPTL3MBTL1ALDH1A1CA9KCNN4
SCHEMBL7684749 0.95 MAPT (0.39) MAPTL3MBTL1ALDH1A1CA9KCNN4
SCHEMBL7979224 0.94 MAPT (0.38) MAPTL3MBTL1ALDH1A1CA9KCNN4
SCHEMBL7979226 0.94 MAPT (0.38) MAPTL3MBTL1ALDH1A1CA9KCNN4
SCHEMBL8121707 0.94 MAPT (0.38) MAPTTSHRL3MBTL1ALDH1A1CA9
SCHEMBL7683865 0.94 KMT2A (0.39) MAPTTSHRL3MBTL1ALDH1A1CA9
SCHEMBL8121711 0.94 MAPT (0.38) MAPTTSHRL3MBTL1ALDH1A1CA9
SCHEMBL7683867 0.94 KMT2A (0.39) MAPTTSHRL3MBTL1ALDH1A1CA9
SCHEMBL7684171 0.93 MAPT (0.42) MAPTTSHRL3MBTL1ALDH1A1CA9

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 MAPT 3732/4885TSHR 1071/4885L3MBTL1 418/4885

“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.