SCHEMBL1695494

SCHEMBL1695494

CCCC(=O)OC1=CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
ALDH1A1 P00352 4/20 0.38
RAB9A P51151 1/20 0.38
BCL9 O00512 1/20 0.37
CTNNB1 P35222 1/20 0.37
GSTP1 P09211 1/20 0.37
CTSK P43235 1/20 0.34
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
NLRP3 Q96P20 1/20 0.33
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL1695769 0.98 ALOX15 (0.38) ALOX15ALDH1A1RAB9ABCL9CTNNB1
SCHEMBL1695483 0.98 ALOX15 (0.38) ALOX15ALDH1A1RAB9ABCL9CTNNB1
SCHEMBL1695767 0.98 ALOX15 (0.38) ALOX15ALDH1A1RAB9ABCL9CTNNB1
SCHEMBL1695492 0.95 ALDH1A1 (0.39) ALOX15ALDH1A1RAB9ABCL9CTNNB1
SCHEMBL3775177 0.89 GSTP1 (0.37) ALDH1A1RAB9AGSTP1CTSKHDAC4
SCHEMBL11801851 0.89 NAAA (0.44) ALOX15ALDH1A1NLRP3KMT2AKDM4E
SCHEMBL7566848 0.87 GSTP1 (0.36) ALDH1A1RAB9AGSTP1CTSKHDAC4
SCHEMBL28240434 0.87 NAAA (0.46) ALOX15ALDH1A1NLRP3MAPTKMT2A
SCHEMBL20210630 0.86 ALDH1A1 (0.34) ALDH1A1RAB9AGSTP1CTSKHDAC2
SCHEMBL1695435 0.86 ESR1 (0.41) ALOX15ALDH1A1RAB9AGSTP1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582453-B1 TRANSESTERIFICATION PROCESS USING MIXED SALT ACETYLACETONATES CATALYSTS ECOSYNTH NV (BE) 2016-12-28 EP disclosed
US-8865931-B2 Transesterification process using mixed salt acetylacetonates catalysts ECOSYNTH BVBA (BE) 2014-10-21 US disclosed
CN-103140287-A Transesterification process using mixed salt acetylacetonates catalysts ECOSYNTH BVBA 2013-06-05 CN disclosed
EP-2582453-A2 TRANSESTERIFICATION PROCESS USING MIXED SALT ACETYLACETONATES CATALYSTS Ecosynth BVBA (BE) 2013-04-24 EP disclosed
US-20130090492-A1 TRANSESTERIFICATION PROCESS USING MIXED SALT ACETYLACETONATES CATALYSTS ECOSYNTH BVBA (BE) 2013-04-11 US disclosed
WO-2011157645-A2 TRANSESTERIFICATION PROCESS USING MIXED SALT ACETYLACETONATES CATALYSTS ECOSYNTH BVBA (BE) 2011-12-22 WO disclosed
US-20050165201-A1 Epoxidizing an alpha-halohydrin intermediate from a halide substitution-deesterification of an alpha -hydroxy ester derivative obtained by the coupling reaction of a phenol and a glycidyl ester BORIACK CLINTON J (US) 2005-07-28 US disclosed
US-20030149219-A1 Process for manufacturing a hydroxyester derivative intermediate and epoxy resins prepared therefrom BORIACK CLINTON J (US) 2003-08-07 US disclosed
US-6534621-B2 Epoxidizing an alpha-halohydrin intermediate produced from an in situ halide substitution-deesterification of an alpha-hydroxy ester derivative DOW GLOBAL TECHNOLOGIES INC. 2003-03-18 US disclosed
EP-1290058-A2 PROCESS FOR MANUFACTURING A HYDROXYESTER DERIVATIVE INTERMEDIATE AND EPOXY RESINS PREPARED THEREFROM DOW GLOBAL TECHNOLOGIES INC. (US) 2003-03-12 EP disclosed
WO-2001088013-A2 PROCESS FOR MANUFACTURING A HYDROXYESTER DERIVATIVE INTERMEDIATE AND EPOXY RESINS PREPARED THEREFROM DOW GLOBAL TECHNOLOGIES INC (US) 2001-11-22 WO disclosed
EP-0428343-B1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO (JP) 1994-05-04 EP disclosed
US-5118863-A Process for producing an α,β-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1992-06-02 US disclosed
EP-0428343-A1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1991-05-22 EP disclosed
US-4112235-A Transesterification of carboxylic acids UOP INC. (US) 1978-09-05 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-20130090492-A1 TRANSESTERIFICATION PROCESS USING MIXED SALT ACETYLACETONATES CATALYSTS ACACA, ACACB, ACSL6 ALOX15 573/4885ALDH1A1 68/4885RAB9A 3866/4885

“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.