SCHEMBL15047671

SCHEMBL15047671

CCCOCCOC(=O)/C=C/C(=O)OCCOCCC

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.63
ATM Q13315 1/20 0.61
TSHR P16473 4/20 0.52
ALDH1A1 P00352 3/20 0.52
TP53 P04637 2/20 0.52
HIF1A Q16665 2/20 0.52
HSD17B10 Q99714 1/20 0.52
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
THRB P10828 2/20 0.43
HPGD P15428 1/20 0.42
APP P05067 1/20 0.41
ALOX5 P09917 1/20 0.40

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
SCHEMBL5342257 1.00 HCAR2 (0.63) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL561312 0.92 HCAR2 (0.55) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL15047600 0.92 ATM (0.70) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL18416707 0.92 HCAR2 (0.55) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL5342254 0.92 HCAR2 (0.78) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL18416719 0.92 HCAR2 (0.55) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL561225 0.92 HCAR2 (0.55) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL6515179 0.87 HCAR2 (0.55) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL9630966 0.87 ATM (0.83) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL9869162 0.87 ATM (0.76) HCAR2ATMTSHRALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237371-A1 HEMIACETYL PROFLAVORS Firmenich SA (CH) 2017-11-01 EP claimed
EP-3236774-A1 PROFLAVOR DELIVERY POWDERS Firmenich SA (CH) 2017-11-01 EP claimed
WO-2016102424-A1 HEMIACETYL PROFLAVORS FIRMENICH SA (CH) 2016-06-30 WO claimed
WO-2016102428-A1 PROFLAVOR DELIVERY POWDERS FIRMENICH SA (CH) 2016-06-30 WO claimed
CN-111587128-B Synthesis and characterization of well-defined polypropylene fumarate and polyethylene glycol block copolymers 阿克伦大学 2022-04-15 CN disclosed
US-20210371645-A1 SYNTHESIS AND CHARACTERIZATION OF WELL DEFINED POLY(PROPYLENE FUMARATE) AND POLY (ETHYLENE GLYCOL) BLOCK COPOLYMERS THE UNIVERSITY OF AKRON (US) 2021-12-02 US disclosed
CN-111587128-A Synthesis and characterization of well-defined polypropylene fumarate and polyethylene glycol block copolymers 阿克伦大学 2020-08-25 CN disclosed
EP-3664858-A1 SYNTHESIS AND CHARACTERIZATION OF WELL DEFINED POLY(PROPYLENE FUMARATE) AND POLY(ETHYLENE GLYCOL) BLOCK COPOLYMERS The University of Akron (US) 2020-06-17 EP disclosed
WO-2019032524-A1 SYNTHESIS AND CHARACTERIZATION OF WELL DEFINED POLY(PROPYLENE FUMARATE) AND POLY(ETHYLENE GLYCOL) BLOCK COPOLYMERS THE UNIVERSITY OF AKRON (US) 2019-02-14 WO disclosed
EP-3236774-A1 PROFLAVOR DELIVERY POWDERS Firmenich SA (CH) 2017-11-01 EP disclosed
EP-3237371-A1 HEMIACETYL PROFLAVORS Firmenich SA (CH) 2017-11-01 EP disclosed
EP-3236773-A1 PROFLAVOR DELIVERY PARTICLES Firmenich SA (CH) 2017-11-01 EP disclosed
WO-2016102424-A1 HEMIACETYL PROFLAVORS FIRMENICH SA (CH) 2016-06-30 WO disclosed
WO-2016102426-A1 PROFLAVOR DELIVERY PARTICLES FIRMENICH SA (CH) 2016-06-30 WO disclosed
WO-2016102428-A1 PROFLAVOR DELIVERY POWDERS FIRMENICH SA (CH) 2016-06-30 WO disclosed
US-20140322309-A1 ALPHA-AMINOAMIDINE POLYMERS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLO (US) 2014-10-30 US disclosed
WO-2013090861-A1 ALPHA-AMINOAMIDINE POLYMERS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-06-20 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 (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-20140322309-A1 ALPHA-AMINOAMIDINE POLYMERS AND USES THEREOF AAAS, AADAT, INMT HCAR2 3194/4885ATM 744/4885TSHR 4764/4885

“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.