SCHEMBL19656683

SCHEMBL19656683

CC(C)OC(=O)NCC(O)CO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
CYP2C19 P33261 4/20 0.34
LMNA P02545 3/20 0.34
HIF1A Q16665 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2D6 P10635 2/20 0.33
HPGD P15428 2/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 2/20 0.32
EGFR P00533 1/20 0.32
SRC P12931 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL12283742 0.81 TSHR (0.39) TSHRCYP2C19LMNASMN1; SMN2ALOX15
SCHEMBL7108959 0.81 EPHX1 (0.38) TSHRCYP2C19LMNAHIF1AHPGD
SCHEMBL7108962 0.81 EPHX1 (0.38) TSHRCYP2C19LMNAHIF1AHPGD
SCHEMBL10828218 0.81 TSHR (0.39) TSHRCYP2C19LMNASMN1; SMN2ALOX15
SCHEMBL6969767 0.79 CYP2D6 (0.52) TSHRCYP2C19LMNASMN1; SMN2ALOX15
SCHEMBL19355186 0.77 SMN1; SMN2 (0.46) TSHRCYP2C19LMNASMN1; SMN2HTT
SCHEMBL606445 0.76
SCHEMBL19355183 0.76 GAA (0.43) TSHRLMNASMN1; SMN2NPC1RAB9A
SCHEMBL20718465 0.75 TSHR (0.37) TSHRCYP2C19LMNASMN1; SMN2ALOX15
SCHEMBL20908170 0.75 TSHR (0.37) TSHRCYP2C19LMNASMN1; SMN2ALOX15

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-20170342046-A1 Fatty Acid Cysteine-Based Conjugates and Their Use in Treating Medical Disorders CATABASIS PHARMACEUTICALS, INC. 2017-11-30 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-20170342046-A1 Fatty Acid Cysteine-Based Conjugates and Their Use in Treating Medical Disorders CPT2, FABP1, ACAA2 TSHR 3232/4885CYP2C19 3277/4885LMNA 3607/4885

“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.