Sugi Predict

Sugi Predict / Compounds / SCHEMBL2892001

SCHEMBL2892001

SCHEMBL2892001

Cc1cc(-n2nc(SC(F)(F)C(F)(F)C(F)(F)F)nc2C(F)(F)F)ccc1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.39
▸ GAA P10253 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ AR P10275 2/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ LMNA P02545 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ CYP2C9 P11712 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ MAPT P10636 4/20 0.32
▸ TP53 P04637 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ PGR P06401 1/20 0.31
▸ CYP2D6 P10635 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
SCHEMBL2889756 0.81 HTT (0.35) HPGDGAATSHRARMEN1
SCHEMBL2161589 0.80 HPGD (0.45) HPGDGAATSHRARMEN1
SCHEMBL2161267 0.79 HPGD (0.42) HPGDGAATSHRARMEN1
SCHEMBL1837878 0.75 HPGD (0.42) HPGDGAATSHRARMEN1
SCHEMBL12402474 0.70 HPGD (0.47) HPGDGAATSHRLMNAPOLB
SCHEMBL1831803 0.69 TRPC3 (0.50) HPGDGAATSHRLMNACYP3A4
SCHEMBL2891803 0.69 HPGD (0.43) HPGDGAATSHRARMEN1
SCHEMBL1836548 0.68 HPGD (0.47) HPGDGAATSHRARHTT
SCHEMBL1827389 0.66 HPGD (0.48) HPGDGAATSHRARMEN1
SCHEMBL1837562 0.66 HPGD (0.45) HPGDGAATSHRARMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130743-A1 HETEROCYCLE-SUBSTITUTED, N-PHENYL-PHTHALAMIDE DERIVATIVES, RELATED COMPOUNDS AND THEIR USE AS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2010-05-27 — — US disclosed
US-7674807-B2 Heterocycle-substituted n-phenyl-phthalamide derivatives, related compounds and their use as insecticides BAYER CROPSCIENCE AG (DE) 2010-03-09 — — US disclosed
EP-1727804-B1 N1 - ((PYRAZOL-1-YMETHYL) -2-METHYLPHENYL)- PHATALAMIDE DERIVATIVES AND RELATED COMPOUNDS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2009-11-04 — — EP disclosed
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides BAYER CROPSCIENCE AG (DE) 2007-12-27 — — 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 (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-20100130743-A1 HETEROCYCLE-SUBSTITUTED, N-PHENYL-PHTHALAMIDE DERIVATIVES, RELATED COMPOUNDS AND THEIR USE AS INSECTICIDES DDT, SQOR, CYP2S1 HPGD 1285/4885GAA 3327/4885TSHR 1924/4885
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides CHRM1, KCNH1, DDT HPGD 1979/4885GAA 1922/4885TSHR 1289/4885

“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.