SCHEMBL2127199

SCHEMBL2127199

COC(=O)Cc1ccc(-c2c(F)cc(OS(=O)(=O)C(F)(F)F)cc2F)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.42
LMNA P02545 2/20 0.41
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
DHODH Q02127 1/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 1/20 0.36
CHEK1 O14757 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ACLY P53396 1/20 0.34
RORC P51449 3/20 0.34
MAPT P10636 2/20 0.34
CNR2 P34972 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 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
SCHEMBL5538841 0.83 CYP4F2 (0.43) PDK2LMNACYP4F2CYP4A11DHODH
SCHEMBL2125414 0.81 HSP90AB1 (0.49) PDK2LMNACYP4F2CYP4A11DHODH
SCHEMBL2125942 0.80 LMNA (0.43) PDK2LMNACYP4F2CYP4A11ALDH1A1
SCHEMBL5538816 0.80 LMNA (0.47) PDK2LMNACYP4F2CYP4A11ALDH1A1
SCHEMBL5538854 0.79 CYP4F2 (0.45) PDK2LMNACYP4F2CYP4A11SMN1; SMN2
SCHEMBL2126853 0.77 PTGS1 (0.50) ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL30154424 0.77 CYP4F2 (0.43) PDK2CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL2126108 0.77 CYP4F2 (0.43) PDK2CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL5537348 0.76 CYP4F2 (0.43) PDK2LMNACYP4F2CYP4A11ALDH1A1
SCHEMBL6296930 0.76 CYP4F2 (0.54) PDK2LMNACYP4F2CYP4A11ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289520-A1 CHEMICAL COMPOUNDS 785 ASTRAZENECA AB (SE) 2012-11-15 US disclosed
US-20120289520-A1 CHEMICAL COMPOUNDS 785 ASTRAZENECA AB (SE) 2012-11-15 US disclosed
US-20120289520-A1 CHEMICAL COMPOUNDS 785 ASTRAZENECA AB (SE) 2012-11-15 US disclosed
US-8188092-B2 Substituted pyrazines as DGAT-1 inhibitors ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188092-B2 Substituted pyrazines as DGAT-1 inhibitors ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188092-B2 Substituted pyrazines as DGAT-1 inhibitors ASTRAZENECA AB (SE) 2012-05-29 US disclosed
EP-2443096-A1 PYRAZINE CARBOXAMIDES AS INHIBITORS OF DGAT1 AstraZeneca AB (SE) 2012-04-25 EP disclosed
US-20100324068-A1 CHEMICAL COMPOUNDS 785 ASTRAZENECA AB (SE) 2010-12-23 US disclosed
US-20100324068-A1 CHEMICAL COMPOUNDS 785 ASTRAZENECA AB (SE) 2010-12-23 US disclosed
US-20100324068-A1 CHEMICAL COMPOUNDS 785 ASTRAZENECA AB (SE) 2010-12-23 US disclosed
WO-2010146395-A1 PYRAZINE CARBOXAMIDES AS INHIBITORS OF DGAT1 ASTRAZENECA AB (SE) 2010-12-23 WO disclosed
WO-2010146395-A1 PYRAZINE CARBOXAMIDES AS INHIBITORS OF DGAT1 ASTRAZENECA AB (SE) 2010-12-23 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-20100324068-A1 CHEMICAL COMPOUNDS 785 GPBAR1, DGAT1, GPR119 PDK2 885/4885LMNA 2019/4885CYP4F2 382/4885
US-20120289520-A1 CHEMICAL COMPOUNDS 785 DGAT1, DGAT2, SLC5A1 PDK2 177/4885LMNA 2647/4885CYP4F2 583/4885

“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.