SCHEMBL782236

SCHEMBL782236

CON1CCC2(CC1)OC(=O)C(c1c(F)cccc1Cl)=C2O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.34
AVPR1A P37288 1/20 0.33
GAA P10253 2/20 0.32
ATM Q13315 1/20 0.32
HDAC4 P56524 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 2/20 0.32
POLB P06746 1/20 0.32
NPY5R Q15761 3/20 0.32
MAPK14 Q16539 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
LMNA P02545 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
SCHEMBL782361 0.92 NPY5R (0.32) MAPTNPY5RLMNA
SCHEMBL782388 0.88 AVPR1A (0.34) AVPR1AHDAC4MAPTNPY5RLMNA
SCHEMBL782469 0.85 ACACB (0.32)
SCHEMBL782389 0.85 ACACB (0.33)
SCHEMBL782427 0.82 KDM4E (0.44) KMT2AMEN1GAAATMSMN1; SMN2
SCHEMBL782383 0.81 NPY5R (0.38) KMT2AMEN1AVPR1AMAPTNPY5R
SCHEMBL782235 0.81 NPY5R (0.38) AVPR1ANPY5R
SCHEMBL782614 0.81 AVPR1A (0.36) AVPR1AMAPTPOLBNPY5RLMNA
SCHEMBL782615 0.80 ACACB (0.31) MAPT
SCHEMBL782250 0.80 SSTR5 (0.34) KDM4ENPY5RLMNA

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 KMT2A 4234/4885MEN1 1302/4885AVPR1A 1446/4885

“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.