SCHEMBL2992226

SCHEMBL2992226

CSCCC(C)NC(=O)c1ccc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)cc1C

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 5/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MARS1 P56192 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31
ALOX12 P18054 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HDAC6 Q9UBN7 3/20 0.31
GCGR P47871 2/20 0.31
FNTA P49354 3/20 0.30
FNTB P49356 3/20 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
SCHEMBL14641786 0.90 MLYCD (0.36) HDAC4CA1CA2KDM4EALDH1A1
SCHEMBL29001060 0.89 HDAC4 (0.32) HDAC4CA1CA2KDM4EALDH1A1
SCHEMBL29516993 0.87 HDAC4 (0.33) HDAC4CA1CA2KDM4EALDH1A1
SCHEMBL2993930 0.87 FNTA (0.33) CA1CA2KDM4EALDH1A1LMNA
SCHEMBL13769684 0.86 HDAC4 (0.32) HDAC4CA1CA2KDM4EALDH1A1
SCHEMBL3105262 0.85 PREP (0.33) TP53
SCHEMBL28908172 0.84 CA1 (0.35) CA1CA2KDM4EALDH1A1
SCHEMBL30984382 0.84 CA1 (0.32) CA1CA2
SCHEMBL28387913 0.84 CA1 (0.34) CA1CA2
SCHEMBL12846270 0.83 S1PR1 (0.33) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3351243-A1 ANIMAL PEST CONTROL METHOD E. I. du Pont de Nemours and Company (US) 2018-07-25 EP claimed
EP-2957284-B1 ANIMAL PEST CONTROL METHOD DU PONT (US) 2018-01-17 EP claimed
EP-2182945-B1 ANIMAL PEST CONTROL METHOD DU PONT (US) 2015-08-05 EP claimed
US-11278533-B2 Animal pest control method E.I. DU PONT DE NEMOURS AND COMPANY (US) 2022-03-22 US disclosed
EP-3927341-A1 LOW DOSE FLURALANER COMPOSITIONS FOR PROTECTION AGAINST PARASITIC INVERTEBRATE PEST VIRBAC (FR) 2021-12-29 EP disclosed
WO-2020201440-A1 LOW DOSE FLURALANER COMPOSITIONS FOR PROTECTION AGAINST PARASITIC INVERTEBRATE PEST VIRBAC (FR) 2020-10-08 WO disclosed
US-20180353494-A1 ANIMAL PEST CONTROL METHOD E. I. DU PONT DE NEMOURS AND COMPANY (US) 2018-12-13 US disclosed
EP-3351243-A1 ANIMAL PEST CONTROL METHOD E. I. du Pont de Nemours and Company (US) 2018-07-25 EP disclosed
EP-2957284-B1 ANIMAL PEST CONTROL METHOD DU PONT (US) 2018-01-17 EP disclosed
US-20160317520-A1 ANIMAL PEST CONTROL METHOD E. I. DU PONT DE NEMOURS AND COMPANY (US) 2016-11-03 US disclosed
EP-2957284-A1 ANIMAL PEST CONTROL METHOD E. I. du Pont de Nemours and Company (US) 2015-12-23 EP disclosed
US-20150272938-A2 ANIMAL PEST CONTROL METHOD E.I. DU PONT DE NEMOURS AND COMPANY (US) 2015-10-01 US disclosed
EP-2182945-B1 ANIMAL PEST CONTROL METHOD DU PONT (US) 2015-08-05 EP disclosed
US-20100173948-A1 ANIMAL PEST CONTROL METHOD E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-08 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 (5 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-20180353494-A1 ANIMAL PEST CONTROL METHOD L3MBTL3, C3AR1, C5 HDAC4 3798/4885CA1 2346/4885CA2 2797/4885
US-11278533-B2 Animal pest control method L3MBTL3, C3AR1, C5 HDAC4 3798/4885CA1 2346/4885CA2 2797/4885
US-20150272938-A2 ANIMAL PEST CONTROL METHOD L3MBTL3, C3AR1, C5 HDAC4 3798/4885CA1 2346/4885CA2 2797/4885
US-20100173948-A1 ANIMAL PEST CONTROL METHOD L3MBTL3, C3AR1, C5 HDAC4 3798/4885CA1 2346/4885CA2 2797/4885
US-20160317520-A1 ANIMAL PEST CONTROL METHOD L3MBTL3, C3AR1, C5 HDAC4 3798/4885CA1 2346/4885CA2 2797/4885

“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.