SCHEMBL22147203

SCHEMBL22147203

CCCCCCCC(C)(CCCC)C(=O)C(C)(C)CC(C)(C)N1C(=O)C=CC1=O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.37
PTGS1 P23219 3/20 0.37
PTGS2 P35354 3/20 0.37
FAAH O00519 2/20 0.37
CES2 O00748 1/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ACAT1 P24752 1/20 0.32
SOAT1 P35610 1/20 0.32
CCR2 P41597 2/20 0.30
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
CXCR4 P61073 1/20 0.30

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
SCHEMBL22147224 0.80 ELANE (0.33) MGLLLMNAMAPT
SCHEMBL18914558 0.77 MGLL (0.50) MGLLPTGS1PTGS2FAAHLMNA
SCHEMBL18569569 0.77 MGLL (0.50) MGLLPTGS1PTGS2FAAHLMNA
SCHEMBL21188048 0.76 ALDH1A1 (0.31) MGLLLMNASMN1; SMN2MAPTALOX15
SCHEMBL18576988 0.76 MGLL (0.47) MGLLPTGS1PTGS2FAAHLMNA
SCHEMBL20096964 0.75 LMNA (0.38) MGLLPTGS1PTGS2FAAHCES2
SCHEMBL20431750 0.71 MGLL (0.50) MGLLPTGS1PTGS2FAAHLMNA
SCHEMBL19687894 0.71 MGLL (0.50) MGLLPTGS1PTGS2FAAHLMNA
SCHEMBL18774136 0.71 MGLL (0.50) MGLLPTGS1PTGS2FAAHLMNA
SCHEMBL19687837 0.71 MGLL (0.50) MGLLPTGS1PTGS2FAAHLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200197524-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES SEATTLE GENETICS, INC. (US) 2020-06-25 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-20200197524-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES NAMPT, NNMT, NADK MGLL 4015/4885PTGS1 2780/4885PTGS2 2789/4885

“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.