SCHEMBL2889756

SCHEMBL2889756

Cc1cc(Cn2nc(SC(F)(F)C(F)(F)C(F)(F)F)nc2C(F)(F)F)ccc1[N+](=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DCTPP1 Q9H773 1/20 0.32
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.31
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
AR P10275 1/20 0.31
MAPT P10636 1/20 0.30
SOS1 Q07889 1/20 0.30
BLM P54132 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
TSHR P16473 1/20 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
SCHEMBL13335217 0.83 DCTPP1 (0.38) HTTMEN1KMT2ADCTPP1HPGD
SCHEMBL2883869 0.83 ADORA3 (0.34)
SCHEMBL1831264 0.81 DCTPP1 (0.36) HTTMEN1KMT2ADCTPP1HPGD
SCHEMBL2892001 0.81 HPGD (0.39) HTTMEN1KMT2AHPGDLMNA
SCHEMBL1836419 0.81 DCTPP1 (0.35) HTTMEN1KMT2ADCTPP1HPGD
SCHEMBL1833620 0.79 DCTPP1 (0.37) HTTMEN1KMT2ADCTPP1HPGD
SCHEMBL12402750 0.77 DCTPP1 (0.34) HTTMEN1KMT2ADCTPP1HPGD
SCHEMBL1831923 0.77 HPGD (0.33) HTTMEN1KMT2AHPGDLMNA
SCHEMBL1835471 0.77 HPGD (0.33) HTTMEN1KMT2ADCTPP1HPGD
SCHEMBL1833080 0.76 HPGD (0.34) HTTMEN1KMT2ADCTPP1HPGD

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 HTT 905/4885MEN1 1134/4885KMT2A 765/4885
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides CHRM1, KCNH1, DDT HTT 1084/4885MEN1 823/4885KMT2A 302/4885

“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.