SCHEMBL5863680

SCHEMBL5863680

CCOC(=O)c1cc(N)ccc1OC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAOA P21397 1/20 0.49
GAA P10253 6/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 7/20 0.47
HSD17B10 Q99714 4/20 0.47
MAPT P10636 4/20 0.47
ALOX15 P16050 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
MAPK1 P28482 2/20 0.46
HPGD P15428 3/20 0.45
TSHR P16473 2/20 0.45
KDM4E B2RXH2 2/20 0.45
IRAK4 Q9NWZ3 1/20 0.43
CA12 O43570 2/20 0.42

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
SCHEMBL28020085 0.85 IDO1 (0.49) LMNAGAAMEN1KMT2ASMN1; SMN2
SCHEMBL1671606 0.83 LMNA (0.53) LMNACYP1A2CYP3A4MAOAGAA
SCHEMBL6588826 0.83 LMNA (0.53) LMNACYP1A2CYP3A4MAOAGAA
SCHEMBL7564303 0.83 GAA (0.54) GAAALDH1A1HSD17B10MAPTALOX15
SCHEMBL23501534 0.82 TSHR (0.50) LMNAGAAMEN1KMT2AALDH1A1
SCHEMBL23635829 0.81 ALDH1A1 (0.51) LMNAGAAMEN1KMT2AALDH1A1
SCHEMBL7904029 0.81 IRAK4 (0.50) CYP3A4GAAMEN1KMT2AALDH1A1
SCHEMBL8442291 0.81 LMNA (0.50) LMNACYP1A2CYP3A4MAOAGAA
SCHEMBL10334181 0.81 LMNA (0.50) LMNACYP1A2CYP3A4MAOAGAA
SCHEMBL6565966 0.80 SMN1; SMN2 (0.45) LMNACYP1A2CYP3A4MAOAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030120-B2 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-18 US disclosed
US-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same OHKURA NAOTO (JP) 2004-11-11 US disclosed
US-6777414-B1 INHIBITORS OF TRIGLYCERIDE BIOSYNTHESIS AND SECRETION OF APOLIPOPROTEIN B-CONTAINING LIPOPROTEINS; ARTERIOSCLEROTIC DISEASES; HYPERLIPIDEMIA MEIJI SEIKA KAISHA, LTD. (JP) 2004-08-17 US disclosed
EP-1180514-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND BENAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2002-02-20 EP 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-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same APOB, NCEH1, LIPC LMNA 508/4885CYP1A2 304/4885CYP3A4 500/4885

“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.