Sugi Predict

Sugi Predict / Compounds / SCHEMBL21450003

SCHEMBL21450003

SCHEMBL21450003

O=C(CSCC(F)(F)F)Nc1ccc(NC(=O)c2cc(NC(=O)[C@H]3[C@H](c4ccc(F)c(C(F)(F)F)c4)C3(Cl)Cl)ccc2Cl)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ FABP4 P15090 1/20 0.35
▸ GRM4 Q14833 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33

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
SCHEMBL22898611 0.92 MEN1 (0.34) MEN1KMT2ALMNAFABP4GRM4
SCHEMBL29995277 0.92 MEN1 (0.37) MEN1KMT2ALMNAFABP4GRM4
SCHEMBL21449936 0.92 MEN1 (0.37) MEN1KMT2ALMNAFABP4GRM4
SCHEMBL21449937 0.91 MEN1 (0.36) MEN1KMT2ALMNAFABP4GRM4
SCHEMBL18147042 0.86 MEN1 (0.45) MEN1KMT2ALMNAGRM4MAPT
SCHEMBL18147038 0.86 MEN1 (0.45) MEN1KMT2ALMNAGRM4MAPT
SCHEMBL22898694 0.85 FABP4 (0.37) MEN1KMT2ALMNAFABP4MAPT
SCHEMBL22898631 0.85 KMT2A (0.35) MEN1KMT2ALMNAFABP4MAPT
SCHEMBL21449959 0.85 MEN1 (0.33) MEN1KMT2ALMNAFABP4GRM4
SCHEMBL22898670 0.85 BRAF (0.35) MEN1KMT2ALMNAFABP4GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3772962-B9 MOLECULES HAVING PESTICIDAL UTILITY, COMPOSITIONS AND PEST CONTROLLING PROCESS RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2023-07-19 — — EP disclosed
EP-3772962-B1 MOLECULES HAVING PESTICIDAL UTILITY, COMPOSITIONS AND PEST CONTROLLING PROCESS RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2023-05-10 — — EP disclosed
US-20210015098-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2021-01-21 — — US disclosed
CN-111698906-A Molecules having pesticidal utility, compositions and pest control methods related thereto 美国陶氏益农公司 2020-09-22 — — CN disclosed
WO-2019194982-A1 MOLECULES HAVING PESTICIDAL UTILITY, COMPOSITIONS AND PEST CONTROLLING PROCESS RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-10-10 — — 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-20210015098-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, DDT, MLYCD MEN1 1180/4885KMT2A 2615/4885LMNA 3364/4885

“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.