SCHEMBL12427702

SCHEMBL12427702

COC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)cnc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 2/20 0.48
PIK3CA P42336 2/20 0.45
MTOR P42345 2/20 0.45
MAPT P10636 1/20 0.45
AXL P30530 2/20 0.43
MAP4K4 O95819 1/20 0.43
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
PTPN11 Q06124 1/20 0.42
KDR P35968 1/20 0.42
LMNA P02545 1/20 0.41
PIK3C3 Q8NEB9 1/20 0.41
IKBKE Q14164 1/20 0.41
TBK1 Q9UHD2 1/20 0.41
POLQ O75417 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2B Q13224 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL14931856 0.88 MAP4K4 (0.50) PIK3CAMTORMAPTMAP4K4PTPN11
SCHEMBL12427705 0.86 PARP1 (0.50) CFTRPIK3C3GRIN1GRIN2BALDH1A1
SCHEMBL2490163 0.84 CFTR (0.48) CFTRMAPTAXLMAP4K4GAA
SCHEMBL5778713 0.83 AXL (0.60) PIK3CAAXLGAALMNAPIK3C3
SCHEMBL16395600 0.83 KMT2A (0.49) CFTRMAPTGAAKMT2AATM
SCHEMBL12427703 0.82 SLC6A4 (0.49) PIK3CAMTORMAPTAXLPIK3C3
SCHEMBL4876885 0.82 AXL (0.59) MAPTAXLGAAKMT2APIK3C3
SCHEMBL14252346 0.79 CFTR (0.60) CFTRMAPT
SCHEMBL25149437 0.78 CFTR (0.47) CFTRMAPTGAAKMT2AALDH1A1
SCHEMBL22770838 0.78 CHRNA7 (0.47) PIK3C3GRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461183-B2 PPAR agonist compounds, preparation and uses GENFIT (FR) 2013-06-11 US disclosed
EP-2310371-B1 PPAR AGONIST COMPOUNDS AND PREPARATION AND USES THEREOF FOR TREATING DIABETES AND/OR DYSLIPIDEMIA GENFIT (FR) 2013-05-15 EP disclosed
US-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES GENFIT (FR) 2011-08-11 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 (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-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES PPARD, PPARA, PPARG CFTR 892/4885PIK3CA 436/4885MTOR 2615/4885

“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.