SCHEMBL2884223

SCHEMBL2884223

Cc1cc(-n2nc(C(F)(F)F)cc2C)ccc1N1C(=O)c2cccc(I)c2C1=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
GRM1 Q13255 5/20 0.37
GRM4 Q14833 5/20 0.37
SCN9A Q15858 4/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPY5R Q15761 1/20 0.35
TYMS P04818 1/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL2889412 0.91 TP53 (0.41) PTGS1PTGS2GRM1GRM4LMNA
SCHEMBL2884049 0.85 TP53 (0.36) PTGS1PTGS2GRM1GRM4LMNA
SCHEMBL2883863 0.84 MAPT (0.38) GRM1GRM4LMNASMN1; SMN2TYMS
SCHEMBL2884293 0.84 GRM1 (0.37) GRM1GRM4LMNASMN1; SMN2TYMS
SCHEMBL2892164 0.79 TP53 (0.39) PTGS1PTGS2GRM1GRM4LMNA
SCHEMBL2887621 0.79 GRM1 (0.46) PTGS1PTGS2GRM1GRM4LMNA
SCHEMBL2887951 0.78 GRM1 (0.36) GRM1GRM4LMNASMN1; SMN2TYMS
SCHEMBL2884079 0.78 GRM1 (0.35) GRM1GRM4LMNASMN1; SMN2TYMS
SCHEMBL2889625 0.78 GRM1 (0.35) GRM1GRM4LMNASMN1; SMN2TYMS
SCHEMBL2884136 0.77 LMNA (0.36) GRM1GRM4LMNASMN1; SMN2TYMS

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
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
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides BAYER CROPSCIENCE AG (DE) 2007-12-27 US disclosed
EP-1727804-A1 N1 - ((PYRAZOL-1-YMETHYL) -2-METHYLPHENYL)- PHATALAMIDE DERIVATIVES AND RELATED COMPOUNDS INSECTICIDES Bayer CropScience Aktiengesellschaft (DE) 2006-12-06 EP disclosed
WO-2005095351-A1 N1 - ((PYRAZOL-1-YMETHYL) -2-METHYLPHENYL)- PHATALAMIDE DERIVATIVES AND RELATED COMPOUNDS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2005-10-13 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 (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 PTGS1 1825/4885PTGS2 1930/4885GRM1 1638/4885
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides CHRM1, KCNH1, DDT PTGS1 1155/4885PTGS2 1426/4885GRM1 1863/4885

“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.