SCHEMBL782383

SCHEMBL782383

CON1CCC2(CC1)OC(=O)C(c1ccccc1F)=C2O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 7/20 0.38
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AVPR1A P37288 2/20 0.36
CHRM3 P20309 1/20 0.34
HSD11B1 P28845 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
NMUR2 Q9GZQ4 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP1B1 Q16678 1/20 0.33
SSTR5 P35346 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
SCHEMBL782253 0.87 THRB (0.35) NPY5RAVPR1ACHRM3HSD11B1
SCHEMBL782243 0.85 NPY5R (0.42) NPY5RMEN1KMT2AAVPR1ACHRM3
SCHEMBL782235 0.85 NPY5R (0.38) NPY5RAVPR1AHSD11B1SIGMAR1CYP1A1
SCHEMBL782254 0.82 NPY5R (0.35) NPY5RMAPTNPSR1AVPR1ACYP1A2
SCHEMBL782599 0.81 PTGS2 (0.39) NPY5RSIGMAR1
SCHEMBL782236 0.81 KMT2A (0.35) NPY5RMEN1MAPTKMT2AAVPR1A
SCHEMBL782307 0.80 ALDH1A1 (0.36) NPY5RMEN1MAPTKMT2ANPSR1
SCHEMBL782250 0.79 SSTR5 (0.34) NPY5RSIGMAR1SSTR5
SCHEMBL769642 0.79 AVPR1A (0.32) NPY5RAVPR1A
SCHEMBL768905 0.79 POLB (0.39) NPY5RMEN1MAPTKMT2AAVPR1A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8574607-B2 Spiroheterocyclic thiofuran dione derivatives SYNGENTA CROP PROTECTION, INC. (US) 2013-11-05 US disclosed
US-8574607-B2 Spiroheterocyclic thiofuran dione derivatives SYNGENTA CROP PROTECTION, INC. (US) 2013-11-05 US disclosed
WO-2012069008-A1 3-SUBSTITUTED SPIROHETEROCYCLIC FURAN AND THIOFURAN DIONE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-05-31 WO disclosed
US-20120071319-A1 SPIROHETEROCYCLIC FURAN AND THIOFURAN DIONE DERIVATIVES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-22 US disclosed
US-20120071319-A1 SPIROHETEROCYCLIC FURAN AND THIOFURAN DIONE DERIVATIVES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-22 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-20120071319-A1 SPIROHETEROCYCLIC FURAN AND THIOFURAN DIONE DERIVATIVES DDT, DHFR, CYP1A1 NPY5R 2496/4885MEN1 1302/4885MAPT 4543/4885

“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.