SCHEMBL3267598

SCHEMBL3267598

CCC1(CC)CC(=O)[N]C1=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.33
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL4998703 0.70 KDM4E (0.36) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL15660796 0.68
SCHEMBL1936577 0.67
SCHEMBL3266525 0.62
SCHEMBL9556652 0.62
SCHEMBL28240135 0.62 KDM4E (0.37) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL4015148 0.59
SCHEMBL3706662 0.59 TSHR (0.58) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL958475 0.58
SCHEMBL15657036 0.57 KDM4E (0.33) KDM4ELMNACYP2C19TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1517881-B1 4-(3,3-DIHALO-ALLYLOXY)PHENOXY ALKYL DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2010-06-02 EP disclosed
US-7414064-B2 4-(3,3-dihalo-allyloxy) phenoxy alkyl derivatives SYNGENTA CROP PROTECTION, INC. (US) 2008-08-19 US disclosed
US-20070142445-A1 4-(3,3-Dihalo-Allyloxy) Phenoxy Alkyl Derivatives SYNGENTA CROP PROTECTION, INC. (US) 2007-06-21 US disclosed
US-7192965-B2 4-(3,3-dihalo-allyloxy)phenoxy alkyl derivatives SYNGENTA CROP PROTECTION, INC. (US) 2007-03-20 US disclosed
US-20050245583-A1 4-(3,3-dihalo-allyloxy)phenoxy alkyl derivatives SYNGENTA CROP PROTECTION, INC. 2005-11-03 US disclosed
EP-1517881-A1 4-(3,3-DIHALO-ALLYLOXY)PHENOXY ALKYL DERIVATIVES Syngenta Participations AG (CH) 2005-03-30 EP disclosed
WO-2004002943-A1 4-(3,3-DIHALO-ALLYLOXY)PHENOXY ALKYL DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2004-01-08 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 (2 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-20050245583-A1 4-(3,3-dihalo-allyloxy)phenoxy alkyl derivatives DDT, RER1, SCN7A KDM4E 4167/4885LMNA 2150/4885CYP2C19 3927/4885
US-20070142445-A1 4-(3,3-Dihalo-Allyloxy) Phenoxy Alkyl Derivatives DDT, RER1, SCN7A KDM4E 4167/4885LMNA 2150/4885CYP2C19 3927/4885

“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.