SCHEMBL2940775

SCHEMBL2940775

CC(C)CCNS(=O)(=O)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORA P35398 9/20 0.50
NR1H3 Q13133 3/20 0.49
RORC P51449 14/20 0.45
RORB Q92753 2/20 0.45
MLYCD O95822 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
NR1H2 P55055 3/20 0.44
NR1H4 Q96RI1 1/20 0.43
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL2943898 0.85 RORA (0.53) RORANR1H3RORCRORBSMN1; SMN2
SCHEMBL11424113 0.82 RORA (0.56) RORANR1H3RORCRORBSMN1; SMN2
SCHEMBL6844016 0.82 RORA (0.50) RORANR1H3RORCRORBMLYCD
SCHEMBL2944332 0.80 NR1H3 (0.66) RORANR1H3RORCRORBMLYCD
SCHEMBL2945810 0.78 RORA (0.49) RORANR1H3RORCRORBMLYCD
SCHEMBL2943579 0.77 MLYCD (0.52) RORANR1H3RORCRORBMLYCD
SCHEMBL2944177 0.77 NR1H3 (0.51) NR1H3MLYCDSMN1; SMN2NR1H2GAA
SCHEMBL11412249 0.74 RORA (0.63) RORANR1H3RORCRORBSMN1; SMN2
SCHEMBL12334564 0.71 NR1H3 (0.59) RORANR1H3RORCRORBMLYCD
SCHEMBL2940660 0.70 RORA (0.55) RORANR1H3RORCRORBMLYCD

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
JP-4503232-B2 2010-07-14 JP claimed
JP-2004521113-A 2004-07-15 JP claimed
US-20040087627-A1 Methods for the treatment of diseases using malonyl-coa decarbox ylase inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2004-05-06 US claimed
EP-1353662-A2 METHODS FOR THE TREATMENT OF DISEASES USING MALONYL-COA DECARBOX YLASE INHIBITORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-10-22 EP claimed
WO-2002058690-A2 METHODS FOR THE TREATMENT OF DISEASES USING MALONYL-COA DECARBOX YLASE INHIBITORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-08-01 WO claimed

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-20040087627-A1 Methods for the treatment of diseases using malonyl-coa decarbox ylase inhibitors ME2, PC, ACACA RORA 2055/4885NR1H3 1227/4885RORC 2163/4885

“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.