SCHEMBL6307249

SCHEMBL6307249

CCOP(=O)(OCC)C(CNc1cnccn1)c1cc(C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
ACHE P22303 1/20 0.34
NR1I2 O75469 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 3/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
NOTUM Q6P988 1/20 0.32
KMT2A Q03164 1/20 0.31
PCSK9 Q8NBP7 1/20 0.31
GAA P10253 1/20 0.30
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL6306511 0.91 KDM4E (0.43) SMN1; SMN2KDM4EALDH1A1ACHETSHR
SCHEMBL6307208 0.86 KDM4E (0.39) SMN1; SMN2KDM4EALDH1A1ACHETSHR
SCHEMBL6306438 0.81 KDM4E (0.41) SMN1; SMN2KDM4EALDH1A1TSHRRAB9A
SCHEMBL27602673 0.75 KDM4E (0.41) SMN1; SMN2KDM4EALDH1A1ACHETSHR
SCHEMBL6310141 0.74 ALPL (0.40) SMN1; SMN2ALDH1A1TSHRRAB9AMAPT
SCHEMBL6306472 0.73 L3MBTL1 (0.38) KDM4EALDH1A1TSHRNOTUM
SCHEMBL6308462 0.72 ALPL (0.45) ALDH1A1TSHRRAB9AMAPTNPC1
SCHEMBL6307570 0.71 MAPT (0.36) SMN1; SMN2KDM4EMAPTKMT2A
SCHEMBL6307857 0.70 ALPL (0.40) SMN1; SMN2KDM4EALDH1A1TSHRRAB9A
SCHEMBL6309420 0.69 L3MBTL1 (0.40) SMN1; SMN2KDM4EACHEMAPTTP53

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
EP-1320536-A1 $g(a)-SUBSTITUTED $g(b)-AMINOETHYL PHOSPHONATES Ilex Oncology Research S.A. (CH) 2003-06-25 EP claimed
US-20020111332-A1 Alpha-substituted beta-aminoethyl phosphonate derivatives ILEX PRODUCTS, INC. 2002-08-15 US claimed
WO-2002026752-A1 α-SUBSTITUTED β-AMINOETHYL PHOSPHONATES ILEX ONCOLOGY RESEARCH S.A. (CH) 2002-04-04 WO claimed
US-20050187193-A1 Reducing plasma levels of apo B and LDL cholesterol and in decreasing plasma total cholesterol; restenosis following angioplasty; atherosclerosis, hypercholesterolemia; use with other drugs such as statins; e.g. diethyl alpha-(3,5-dimethoxy-4-hydroxyphenyl)-beta-(N-(3-pyridyl)-amino)-vinylphosphonate ILEX PRODUCTS, INC. 2005-08-25 US disclosed
US-6706698-B2 ANTICHOLESTEROL AGENTS ILEX PRODUCTS, INC. 2004-03-16 US disclosed
EP-1320536-A1 $g(a)-SUBSTITUTED $g(b)-AMINOETHYL PHOSPHONATES Ilex Oncology Research S.A. (CH) 2003-06-25 EP disclosed
US-20030114421-A1 Alpha-substituted beta-aminoethyl phosphonate derivatives PHAN HIEU TRUNG (CH) 2003-06-19 US disclosed
US-20020111332-A1 Alpha-substituted beta-aminoethyl phosphonate derivatives ILEX PRODUCTS, INC. 2002-08-15 US disclosed
WO-2002026752-A1 α-SUBSTITUTED β-AMINOETHYL PHOSPHONATES ILEX ONCOLOGY RESEARCH S.A. (CH) 2002-04-04 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 (3 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-20030114421-A1 Alpha-substituted beta-aminoethyl phosphonate derivatives APOB, PHOSPHO1, APOL1 HMGCR 89/4885SMN1; SMN2 4063/4885KDM4E 1456/4885
US-20020111332-A1 Alpha-substituted beta-aminoethyl phosphonate derivatives APOB, PHOSPHO1, APOL1 HMGCR 89/4885SMN1; SMN2 4063/4885KDM4E 1456/4885
US-20050187193-A1 Reducing plasma levels of apo B and LDL cholesterol and in decreasing plasma total cholesterol; restenosis following angioplasty; atherosclerosis, hypercholesterolemia; use with other drugs such as statins; e.g. diethyl alpha-(3,5-dimethoxy-4-hydroxyphenyl)-beta-(N-(3-pyridyl)-amino)-vinylphosphonate APOB, LDLR, HDLBP HMGCR 5/4885SMN1; SMN2 4593/4885KDM4E 1687/4885

“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.