SCHEMBL3784261

SCHEMBL3784261

C=C(C)COC(=O)C1CC=CCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.39
ALDH1A1 P00352 2/20 0.35
ALOX15 P16050 2/20 0.35
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
ESR2 Q92731 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
TSHR P16473 2/20 0.32
MAPK1 P28482 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
RAB9A P51151 3/20 0.31

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
SCHEMBL3780197 0.91 SMN1; SMN2 (0.33) MIFALDH1A1ALOX15MEN1KMT2A
SCHEMBL3788658 0.88 ALOX15 (0.33) ALDH1A1ALOX15MEN1MAPTKMT2A
SCHEMBL3789494 0.84 ALDH1A1 (0.44) MIFALDH1A1ALOX15HTTMEN1
SCHEMBL3788162 0.84 MIF (0.39) MIFALDH1A1ALOX15HTTMEN1
SCHEMBL472121 0.80 MAPT (0.44) MIFALDH1A1ALOX15MEN1MAPT
SCHEMBL25648750 0.80 MAPT (0.44) MIFALDH1A1ALOX15MEN1MAPT
SCHEMBL29084231 0.80 MAPT (0.44) MIFALDH1A1ALOX15MEN1MAPT
SCHEMBL11835168 0.79 MIF (0.44) MIFALDH1A1ALOX15HTTMEN1
SCHEMBL17862134 0.79 MIF (0.44) MIFALDH1A1ALOX15HTTMEN1
SCHEMBL10325880 0.79 MAPT (0.41) ALDH1A1HTTMAPTPKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7696366-B2 Production process of bifunctional epoxy monomer by selective oxidation of diolefin compound SHOWA DENKO K.K. (JP) 2010-04-13 US claimed
US-7696366-B2 Production process of bifunctional epoxy monomer by selective oxidation of diolefin compound SHOWA DENKO K.K. (JP) 2010-04-13 US disclosed
EP-1891031-B1 PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND SHOWA DENKO KK (JP) 2009-03-11 EP disclosed
US-20090030217-A1 PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND SHOWA DENKO K.K. (JP) 2009-01-29 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-20090030217-A1 PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND DUOX2, DUOX1, DDT MIF 1324/4885ALDH1A1 747/4885ALOX15 424/4885

“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.