SCHEMBL7683950

SCHEMBL7683950

CCOC(=O)CN1C(=O)CSC1=Nc1cc(N2C(=O)CC(C(F)(F)F)CC2=O)c(F)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.40
PPOX P50336 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 2/20 0.34
USP2 O75604 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ATM Q13315 1/20 0.34
MAPT P10636 2/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PPARG P37231 1/20 0.31
CCKAR P32238 1/20 0.31
CCKBR P32239 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
SCHEMBL7683943 1.00 NPSR1 (0.40) NPSR1PPOXL3MBTL1LMNAGAA
SCHEMBL7680275 0.84 PPOX (0.57) NPSR1PPOXL3MBTL1LMNAGAA
SCHEMBL7682499 0.80 NPSR1 (0.37) NPSR1PPOXL3MBTL1LMNAGAA
SCHEMBL7682492 0.80 NPSR1 (0.37) NPSR1PPOXL3MBTL1LMNAGAA
SCHEMBL7682214 0.74 L3MBTL1 (0.32) L3MBTL1
SCHEMBL7688854 0.74 L3MBTL1 (0.33) L3MBTL1
SCHEMBL7682210 0.74 L3MBTL1 (0.32) L3MBTL1
SCHEMBL7688855 0.74 L3MBTL1 (0.33) L3MBTL1
SCHEMBL7976331 0.73 L3MBTL1 (0.33) NPSR1L3MBTL1MEN1KMT2A
SCHEMBL7976336 0.73 L3MBTL1 (0.33) NPSR1L3MBTL1MEN1KMT2A

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 2 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
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 NPSR1 4145/4885PPOX 2586/4885L3MBTL1 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.