SCHEMBL2943548

SCHEMBL2943548

COC(=O)CN(C(=O)C(C)C)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 19/20 1.00
GAA P10253 1/20 0.49
MAPK1 P28482 1/20 0.49
NR1H3 Q13133 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL5231374 0.85 MLYCD (1.00) MLYCDGAAMAPK1NR1H3SMN1; SMN2
SCHEMBL2944447 0.84 MLYCD (1.00) MLYCD
SCHEMBL4988361 0.82 MLYCD (1.00) MLYCD
SCHEMBL3235441 0.80 MLYCD (1.00) MLYCD
SCHEMBL6843869 0.78 MLYCD (1.00) MLYCD
SCHEMBL2940138 0.78 MLYCD (0.71) MLYCDGAAMAPK1NR1H3SMN1; SMN2
SCHEMBL2937261 0.75 MLYCD (1.00) MLYCD
SCHEMBL2938172 0.74 MLYCD (1.00) MLYCD
SCHEMBL2945877 0.74 MLYCD (0.78) MLYCD
SCHEMBL10685777 0.71 MLYCD (0.55) MLYCDGAAMAPK1NR1H3SMN1; SMN2

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 MLYCD 6/4885GAA 12/4885MAPK1 2521/4885

“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.