SCHEMBL782385

SCHEMBL782385

CON1CCC2(CC1)OC(=O)C(c1ccc(C)cc1Cl)=C2O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.37
AVPR1A P37288 5/20 0.35
POLB P06746 1/20 0.33
NPY5R Q15761 1/20 0.33
PTGS2 P35354 2/20 0.33
HTR2C P28335 1/20 0.33
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
RECQL P46063 1/20 0.32
HPGD P15428 1/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
SSTR5 P35346 1/20 0.31
LMNA P02545 2/20 0.30
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
GFER P55789 1/20 0.30
KMT2A Q03164 1/20 0.30
PTGS1 P23219 1/20 0.30

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
SCHEMBL782595 0.90 PTGS2 (0.42) AVPR1APOLBNPY5RPTGS2MAPT
SCHEMBL782228 0.89 POLB (0.36) THRBAVPR1APOLBNPY5RPTGS2
SCHEMBL768905 0.86 POLB (0.39) AVPR1APOLBNPY5RPTGS2MAPT
SCHEMBL782235 0.86 NPY5R (0.38) AVPR1ANPY5RSSTR5
SCHEMBL782356 0.84 MAPT (0.37) AVPR1APOLBNPY5RMAPTALDH1A1
SCHEMBL782490 0.84 AVPR1A (0.35) THRBAVPR1ANPY5RPTGS2MAPT
SCHEMBL782272 0.83 AVPR1A (0.34) AVPR1APOLBNPY5RPTGS2HTR2C
SCHEMBL782502 0.83 ACACB (0.31) MAPTALDH1A1RECQLACACBACACA
SCHEMBL9290064 0.82 TSHR (0.31) THRB
SCHEMBL782257 0.81 AVPR1A (0.39) THRBAVPR1APOLBNPY5RHTR2C

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-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
WO-2010135914-A1 NEW SPIROHETEROCYCLIC FURAN AND THIOFURAN DIONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2010-12-02 WO 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 THRB 436/4885AVPR1A 1446/4885POLB 4426/4885

“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.