SCHEMBL5864056

SCHEMBL5864056

CCOC(=O)c1cc(NC(=O)OCc2ccccc2)ccc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.52
RAB9A P51151 3/20 0.50
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 2/20 0.50
TSHR P16473 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NAMPT P43490 1/20 0.50
TP53 P04637 1/20 0.50
ATM Q13315 1/20 0.50
LMNA P02545 2/20 0.49
MAPK1 P28482 2/20 0.48
HSD17B10 Q99714 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL5863964 0.88 P2RX3 (0.49) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL6880261 0.84 ABCB1 (0.49) MGLLRAB9AMAPTALDH1A1NPC1
SCHEMBL22808210 0.84 SMN1; SMN2 (0.63) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL10878991 0.82 NPC1 (0.55) RAB9AMAPTALDH1A1KMT2ANPC1
SCHEMBL9872046 0.82 MGLL (0.55) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL3038608 0.82 MGLL (0.58) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL7145345 0.81 MGLL (0.49) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL14183670 0.81 POLB (0.67) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL11694836 0.81 TP53 (0.57) MGLLRAB9AMAPTALDH1A1KMT2A
SCHEMBL20389370 0.79 NAMPT (0.76) RAB9AMAPTALDH1A1KMT2ANPC1

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 MGLL 61/4885RAB9A 3295/4885MAPT 4733/4885

“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.