SCHEMBL256056

SCHEMBL256056

CC/C=C/c1cccc(OC(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
CHRM2 P08172 2/20 0.42
CHRM1 P11229 2/20 0.42
CHRM3 P20309 2/20 0.42
NFE2L2 Q16236 4/20 0.41
CHEK1 O14757 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RELA Q04206 1/20 0.40
FBP1 P09467 1/20 0.40
ALOX5 P09917 1/20 0.38
ALOX5AP P20292 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38

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
SCHEMBL27295735 1.00 PIM1 (0.44) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL2095719 0.84 PIM1 (0.47) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL4077103 0.84 PIM1 (0.44) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL8705946 0.84 PIM1 (0.44) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL4077112 0.84 PIM1 (0.44) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL8705948 0.84 PIM1 (0.44) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL2095720 0.84 PIM1 (0.47) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL2091116 0.83 PIM1 (0.46) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL13841249 0.81 PIM1 (0.47) PIM1PIM2CHRM2CHRM1CHRM3
SCHEMBL13562810 0.81 PIM1 (0.47) PIM1PIM2CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220024906-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2022-01-27 US disclosed
WO-2012028578-A1 SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES BAYER CROPSCIENCE AG (DE) 2012-03-08 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-20220024906-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 PIM1 2978/4885PIM2 3074/4885CHRM2 3122/4885

“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.