SCHEMBL6340366

SCHEMBL6340366

CCCCN(C(C)=O)c1ccc(O)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 2/20 0.46
GAA P10253 1/20 0.46
SERPINE1 P05121 2/20 0.42
IAPP P10997 2/20 0.42
MEN1 O00255 1/20 0.41
RGS12 O14924 1/20 0.41
USP2 O75604 1/20 0.41
THRB P10828 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
NFKB1 P19838 1/20 0.41
APEX1 P27695 1/20 0.41
MAPK1 P28482 1/20 0.41
BRCA1 P38398 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
GNAI1 P63096 1/20 0.41

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
SCHEMBL9444650 0.86 ALDH1A1 (0.44) ALDH1A1KDM4EPOLBGAASERPINE1
SCHEMBL22521802 0.84 GAA (0.42) ALDH1A1KDM4EPOLBGAA
SCHEMBL6346993 0.83 SMN1; SMN2 (0.46) ALDH1A1KDM4EPOLBSERPINE1IAPP
SCHEMBL9614627 0.81 HSD17B3 (0.44) ALDH1A1KDM4EPOLBGAAMAPK1
SCHEMBL9345427 0.81 ALDH1A1 (0.49) ALDH1A1KDM4EPOLBGAASERPINE1
SCHEMBL6161568 0.81 NPC1 (0.43) ALDH1A1KDM4EPOLBGAASERPINE1
SCHEMBL11088728 0.81 GABRA1 (0.44) ALDH1A1KDM4EPOLBGAAMEN1
SCHEMBL9350017 0.80 NPC1 (0.51) ALDH1A1SERPINE1IAPPMEN1KMT2A
SCHEMBL9346640 0.80 NPC1 (0.51) ALDH1A1SERPINE1IAPPMEN1KMT2A
SCHEMBL9345359 0.80 NPC1 (0.51) ALDH1A1SERPINE1IAPPMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050080260-A1 Preparation of prodrugs for selective drug delivery LUMINIDE 2005-04-14 US claimed
US-20050080260-A1 Preparation of prodrugs for selective drug delivery LUMINIDE 2005-04-14 US disclosed
US-6555663-B1 Pharmaceuticals which are activated intracellularly by reaction with cellular electron carriers or free radicals to cause release of a free and active drug molecule MILLS RANDELL LEE (US) 2003-04-29 US disclosed
EP-0414730-B1 Chemical Compounds and pharmaceutical compositions capable of releasing a drug MILLS RANDELL L (US) 1999-12-15 EP disclosed
US-5773592-A COMPRISES A CHEMILUMINESCENT MOIETY, A PHOTOCHROMIC MOIETY AND A BIOLOGICALLY ACTIVE AGENT CAPABLE OF BEING RELEASED MILLS RANDELL LEE (US) 1998-06-30 US disclosed
US-5428163-A Luminides; chemiluminescence; redox system, releasing free drug MILLS RANDELL L (US) 1995-06-27 US disclosed
EP-0414730-A4 LUMINIDE AND MACROLUMINIDE CLASS OF PHARMACEUTICALS 1993-06-16 EP disclosed
EP-0414730-A1 LUMINIDE AND MACROLUMINIDE CLASS OF PHARMACEUTICALS Mills, Randell L. (US) 1991-03-06 EP disclosed
WO-1989009833-A1 LUMINIDE AND MACROLUMINIDE CLASS OF PHARMACEUTICALS MILLS RANDELL L (US) 1989-10-19 WO 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-20050080260-A1 Preparation of prodrugs for selective drug delivery APEH, PAH, ALAD ALDH1A1 61/4885KDM4E 3072/4885POLB 502/4885

“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.