SCHEMBL6027463

SCHEMBL6027463

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.56
NR1H2 P55055 1/20 0.50
NR1H3 Q13133 1/20 0.50
CYP3A4 P08684 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KMT2A Q03164 6/20 0.46
NPC1 O15118 1/20 0.46
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 5/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL6026850 0.91 ELANE (0.60) ELANENR1H2SMN1; SMN2KMT2ANPC1
SCHEMBL6026715 0.90 ELANE (0.63) ELANEKMT2AESR1
SCHEMBL6026762 0.89 NR1H2 (0.59) ELANENR1H2NR1H3CYP3A4SMN1; SMN2
SCHEMBL6026870 0.84 ELANE (0.46) ELANENR1H2NR1H3SMN1; SMN2TDP1
SCHEMBL6026766 0.83 KMT2A (0.45) ELANENR1H2NR1H3SMN1; SMN2TDP1
SCHEMBL6026095 0.81 ELANE (0.48) ELANENR1H2NR1H3SMN1; SMN2TDP1
SCHEMBL6026747 0.81 ELANE (0.48) ELANENR1H2NR1H3SMN1; SMN2TDP1
SCHEMBL7965056 0.79 CYP3A4 (0.51) ELANECYP3A4SMN1; SMN2TDP1KMT2A
SCHEMBL6026922 0.79 ELANE (0.52) ELANESMN1; SMN2TDP1KMT2ANPC1
SCHEMBL6027161 0.78 ELANE (0.46) ELANENR1H2NR1H3SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-1205198-C Cyclic ketone derivative and pharmaceutical use thereof TORAY INDUSTRIES (JP) 2005-06-08 CN disclosed
WO-2003099008-A1 USE OF PYRONE CARBOXYLATES FOR CONTROLLING PESTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-04 WO disclosed
US-6184245-B1 Cyclic ketone derivatives and their medical applications TORAY INDUSTRIES INC. (JP) 2001-02-06 US disclosed
CN-1242770-A Cyclic ketone derivative and pharmaceutical use thereof TORAY INDUSTRIES (JP) 2000-01-26 CN disclosed
EP-0962456-A1 CYCLIC KETONE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1999-12-08 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-20050159479-A1 Use of pyrone carboxylates for controlling pests TET1, TET3, CNPY3 ELANE 2080/4885NR1H2 3082/4885NR1H3 3009/4885

“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.