SCHEMBL6763543

SCHEMBL6763543

CC(C)(C)OC(=O)C(CSCC(=O)c1ccc(OCc2c(F)cccc2F)cc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
MAOB P27338 2/20 0.37
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
PTPN1 P18031 1/20 0.36
ALKBH1 Q13686 1/20 0.36
PPARG P37231 3/20 0.36
PPARA Q07869 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PPARD Q03181 2/20 0.35
LTA4H P09960 1/20 0.35
PARP15 Q460N3 1/20 0.35

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
SCHEMBL2086618 1.00 ALDH1A1 (0.40) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL12934372 0.85 PPARA (0.53) ALDH1A1MAPTPTPN1PPARGPPARA
SCHEMBL2089430 0.81 ALDH1A1 (0.36) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL2641408 0.80 MEN1 (0.38) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL14389918 0.78 PPARG (0.42) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL6322990 0.76 MAOB (0.43) MAPTMAOBRAB9ANPC1ALKBH1
SCHEMBL6322991 0.75 MAOB (0.42) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL27594863 0.74 MAOB (0.47) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL2087206 0.74 MAOB (0.47) ALDH1A1MAPTMAOBRAB9ANPC1
SCHEMBL27750738 0.73 MAOB (0.45) ALDH1A1MAPTMAOBRAB9ANPC1

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-20040236100-A1 Compounds for the treatment of metabolic disorders WELLSTAT THERAPEUTICS CORPORATION 2004-11-25 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-20040236100-A1 Compounds for the treatment of metabolic disorders GOT2, OAT, CPT1B ALDH1A1 1035/4885MAPT 3564/4885MAOB 589/4885

“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.