SCHEMBL4095108

SCHEMBL4095108

O=[N+]([O-])c1ccc(OC2CCCCO2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
SLC18A3 Q16572 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HSPB1 P04792 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL16021495 1.00 HTT (0.44) HTTPOLBLMNAGAAMAPT
SCHEMBL11068617 0.95 HTT (0.48) HTTPOLBLMNAGAAMAPT
SCHEMBL31357139 0.91 CES2 (0.46) HTTPOLBLMNAGAAMAPT
SCHEMBL27006326 0.88 KMT2A (0.54) HTTPOLBGAAMAPTMEN1
SCHEMBL3500438 0.83 TNK2 (0.44) POLBLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL1025068 0.83 SLC6A2 (0.52) POLBLMNA
SCHEMBL2367956 0.81 MEN1 (0.56) HTTMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL5206947 0.78 IDO1 (0.46) HTTPOLBLMNAGAAMAPT
SCHEMBL8740885 0.78 PKM (0.44) HTTLMNAGAAMEN1KMT2A
SCHEMBL10924129 0.78 MAPK1 (0.41) LMNAMAPTMEN1KMT2ASMN1; SMN2

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
EP-0384134-A2 Preparation of linear polycarbonates from cyclic oligomer compositions using aryl tetrahydropyranyl ether catalyst GENERAL ELECTRIC COMPANY (US) 1990-08-29 EP claimed
US-4927910-A Preparation of linear polycarbonates from cyclic oligomer compositions using aryl tetrahydropyranyl ether catalyst GENERAL ELECTRIC COMPANY (US) 1990-05-22 US claimed
JP-2283725-A None JP disclosed
US-8362150-B2 Gas-phase anionic polymerization BRIDGESTONE CORPORATION (JP) 2013-01-29 US disclosed
US-20090209708-A1 GAS-PHASE ANIONIC POLYMERIZATION BRIDGESTONE CORPORATION (JP) 2009-08-20 US disclosed
US-20090143332-A1 Cyclodextrin Cyanohydrins AARHUS UNIVERSITET (DK) 2009-06-04 US disclosed
WO-2006084469-A1 CYCLODEXTRIN CYANOHYDRINS AARHUS UNIVERSITET (DK) 2006-08-17 WO disclosed
JP-H02283725-A PRODUCTION OF LINEAR POLYCARBONATE FROM CYCLIC OLIGOMER COMPOSITION BY USING ARYL TETRAHYDROPYRANYL ETHER GENERAL ELECTRIC CO <GE> 1990-11-21 JP disclosed
EP-0384134-A2 Preparation of linear polycarbonates from cyclic oligomer compositions using aryl tetrahydropyranyl ether catalyst GENERAL ELECTRIC COMPANY (US) 1990-08-29 EP disclosed
US-4297129-A HERBICIDES; WILD OATS; NONPHYTOTOXIC SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-27 US 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-20090143332-A1 Cyclodextrin Cyanohydrins PYGL, CBR3, CYP2B6 HTT 1324/4885POLB 4038/4885LMNA 3135/4885

“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.