SCHEMBL6503635

SCHEMBL6503635

CC(C)(C)OC(=O)Nc1nc(CCNC(=O)O)cs1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 1/20 0.47
SIRT1 Q96EB6 1/20 0.46
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 6/20 0.44
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
AOC3 Q16853 1/20 0.40
KCNH2 Q12809 1/20 0.40
HPGD P15428 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
SCHEMBL944485 0.84 PI4KB (0.51) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA
SCHEMBL12742401 0.84 PTPRB (0.49) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL28584083 0.84 SIRT1 (0.46) PI4KBSIRT1ALDH1A1SMN1; SMN2GAA
SCHEMBL6495932 0.83 AOC3 (0.54) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA
SCHEMBL2668827 0.83 SIRT1 (0.48) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA
SCHEMBL299175 0.82 SMN1; SMN2 (0.51) PI4KBSIRT1ALDH1A1SMN1; SMN2MAPT
SCHEMBL24434982 0.81 AOC3 (0.53) SIRT1SMN1; SMN2LMNAKMT2ANPC1
SCHEMBL1030124 0.81 PI4KB (0.50) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA
SCHEMBL2175797 0.81 SMN1; SMN2 (0.50) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6679893 0.80 SIRT1 (0.49) PI4KBSIRT1ALDH1A1SMN1; SMN2LMNA

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 PI4KB 1625/4885SIRT1 804/4885ALDH1A1 1603/4885

“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.