SCHEMBL6026933

SCHEMBL6026933

CCC(=O)c1c(O)cc(C)oc1=O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.68
GAA P10253 2/20 0.55
KMT2A Q03164 6/20 0.53
MEN1 O00255 5/20 0.53
CYP3A4 P08684 1/20 0.53
PTGS1 P23219 1/20 0.53
DRD3 P35462 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 5/20 0.50
POLB P06746 1/20 0.49
LMNA P02545 1/20 0.49
NPC1 O15118 1/20 0.48
PKM P14618 1/20 0.48
RAB9A P51151 1/20 0.48
USP2 O75604 1/20 0.47
PPARG P37231 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL11769303 0.86 ELANE (0.78) ELANEGAAKMT2AMEN1L3MBTL1
SCHEMBL27921576 0.83 ELANE (0.89) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL27035914 0.83 ELANE (0.88) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL27035967 0.83 ELANE (0.88) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL27035935 0.83 ELANE (0.88) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL27035891 0.83 ELANE (0.88) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL27035911 0.83 ELANE (0.88) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL10337601 0.82 ELANE (0.97) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL23146904 0.81 ELANE (0.58) ELANEGAAKMT2AMEN1L3MBTL1
SCHEMBL7221645 0.81 ELANE (0.58) ELANEGAAKMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103214442-B 3-substituted alpha-pyrone derivative as well as preparation method and application thereof BIOLOGY INST SHANDONG ACAD SCI 2014-09-10 CN claimed
US-9133155-B2 Antibacterial agents: high-potency myxopyronin derivatives RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-09-15 US disclosed
US-9133155-B2 Antibacterial agents: high-potency myxopyronin derivatives RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-09-15 US disclosed
CN-103360308-A 1,4-dyhydroxy-6-methyl-2-pyridine ketone compound, and preparation method and use thereof SUN WEIXIN 2013-10-23 CN disclosed
US-20130237595-A1 ANTIBACTERIAL AGENTS: HIGH-POTENCY MYXOPYRONIN DERIVATIVES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2013-09-12 US disclosed
US-20130237595-A1 ANTIBACTERIAL AGENTS: HIGH-POTENCY MYXOPYRONIN DERIVATIVES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2013-09-12 US disclosed
WO-2012037508-A2 ANTIBACTERIAL AGENTS: HIGH-POTENCY MYXOPYRONIN DERIVATIVES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2012-03-22 WO disclosed
US-7067523-B2 Use of pyrone carboxylates for controlling pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-06-27 US disclosed
US-20050159479-A1 Use of pyrone carboxylates for controlling pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-07-21 US disclosed
WO-2003099008-A1 USE OF PYRONE CARBOXYLATES FOR CONTROLLING PESTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-04 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 (2 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-20050159479-A1 Use of pyrone carboxylates for controlling pests TET1, TET3, CNPY3 ELANE 2080/4885GAA 4656/4885KMT2A 2113/4885
US-20130237595-A1 ANTIBACTERIAL AGENTS: HIGH-POTENCY MYXOPYRONIN DERIVATIVES YBX1, POLRMT, YBX3 ELANE 2782/4885GAA 893/4885KMT2A 2097/4885

“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.