SCHEMBL2058801

SCHEMBL2058801

CC(C)=CC1C(C)(C)[C@]1(Cc1c(F)c(F)c(C)c(F)c1F)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
IMPDH2 P12268 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
SCHEMBL439569 1.00 MEN1 (0.34) MEN1KMT2ATDP1IMPDH2
SCHEMBL441416 0.89 MEN1 (0.34) MEN1KMT2ATDP1
SCHEMBL441129 0.89 MEN1 (0.39) MEN1KMT2ATDP1
SCHEMBL4898640 0.86 MEN1 (0.37) MEN1KMT2ATDP1
SCHEMBL2058740 0.86 MEN1 (0.31) MEN1KMT2ATDP1
SCHEMBL7918011 0.86 MEN1 (0.33) MEN1KMT2ATDP1
SCHEMBL2058671 0.85
SCHEMBL2058788 0.85 IMPDH2 (0.34) IMPDH2
SCHEMBL7534741 0.85
SCHEMBL3419268 0.85 MEN1 (0.30) MEN1KMT2ATDP1

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-0926129-B1 Ester compound and pesticide containing it SUMITOMO CHEMICAL CO (JP) 2002-03-20 EP claimed
EP-0926129-A1 Ester compound and pesticide containing it SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-30 EP claimed
US-7968598-B2 Pesticides; 4-methoxy- or 4-allyl-2,3,5,6-tetrafluorobenzyl (1R)-trans-3-(2-cyano-1-propenyl)-2,2-dimethylcyclopropanecarboxylate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-28 US disclosed
US-20100035985-A1 Ester Compound and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-11 US disclosed
EP-0926129-B1 Ester compound and pesticide containing it SUMITOMO CHEMICAL CO (JP) 2002-03-20 EP disclosed
US-6225495-B1 PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-01 US disclosed
EP-0926129-A1 Ester compound and pesticide containing it SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-30 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-20100035985-A1 Ester Compound and Use Thereof CYP51A1, CYP4A11, CYP2E1 MEN1 1313/4885KMT2A 1549/4885TDP1 4255/4885

“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.