SCHEMBL23639147

SCHEMBL23639147

CC(O)COc1cccc(OCCO)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
TSHR P16473 2/20 0.53
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 2/20 0.50
RECQL P46063 1/20 0.50
HIF1A Q16665 1/20 0.49
KDM4E B2RXH2 4/20 0.45
MTNR1A P48039 3/20 0.43
MTNR1B P49286 3/20 0.43
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ACE2 Q9BYF1 1/20 0.42
NSD2 O96028 1/20 0.41

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
SCHEMBL23696892 0.97 LMNA (0.56) LMNATSHRMAPK1ALDH1A1RECQL
SCHEMBL1241813 0.89 LMNA (0.73) LMNATSHRMAPK1HIF1AKDM4E
SCHEMBL13881619 0.85 LMNA (0.58) LMNATSHRMAPK1HIF1AKDM4E
SCHEMBL48418 0.83 ALDH1A1 (0.70) TSHRMAPK1ALDH1A1RECQL
SCHEMBL1496491 0.82 TSHR (0.70) LMNATSHRMAPK1HIF1AKDM4E
SCHEMBL29847698 0.82 TSHR (0.70) LMNATSHRMAPK1HIF1AKDM4E
Ethylene Glycol SCHEMBL7206927 0.81 ALDH1A1 (0.67) TSHRMAPK1ALDH1A1RECQL
SCHEMBL772516 0.80 TSHR (0.54) LMNATSHRMAPK1ALDH1A1RECQL
Di(Hydroxyethyl)Ether SCHEMBL7865305 0.79 LMNA (0.76) LMNAALDH1A1RECQLHIF1AMTNR1A
Phenoxyethanol SCHEMBL4931326 0.79 ALDH1A1 (0.66) LMNAALDH1A1RECQLMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210230342-A1 COMPOSITION CONTAINING MODIFIED BISPHENOL F JPMORGAN CHASE BANK, N.A. 2021-07-29 US disclosed
US-20210214295-A1 PROCESS FOR PRODUCTION OF AN ALKOXYLATED PRODUCT JPMORGAN CHASE BANK, N.A. 2021-07-15 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 (2 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-20210230342-A1 COMPOSITION CONTAINING MODIFIED BISPHENOL F PCBP1, PUF60, FHIT LMNA 1834/4885TSHR 4104/4885MAPK1 4775/4885
US-20210214295-A1 PROCESS FOR PRODUCTION OF AN ALKOXYLATED PRODUCT ALKBH3, PUF60, CYP4F11 LMNA 1884/4885TSHR 4042/4885MAPK1 4468/4885

“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.