SCHEMBL22112059

SCHEMBL22112059

CC(C)COC(=O)CCOCCN

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.37
CYP1A2 P05177 1/20 0.37
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
THRB P10828 1/20 0.36
CNR1 P21554 1/20 0.36
TLR2 O60603 1/20 0.36
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
EPHX2 P34913 1/20 0.33
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
ATM Q13315 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA1A P35348 1/20 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
SCHEMBL23157471 0.98 TLR2 (0.38) TSHRCYP1A2ALDH1A1MAPTTHRB
SCHEMBL22489508 0.98 TLR2 (0.38) TSHRCYP1A2ALDH1A1MAPTTHRB
SCHEMBL19519866 0.98 TLR2 (0.38) TSHRCYP1A2ALDH1A1MAPTTHRB
Ethylenediamine SCHEMBL7702384 0.86 TSHR (0.43) TSHRCYP1A2ALDH1A1MAPTTHRB
SCHEMBL4859360 0.84 TSHR (0.42) TSHRALDH1A1MAPTPOLBGAA
SCHEMBL27386816 0.84 TDP1 (0.42) TSHRALDH1A1TLR2POLBGAA
SCHEMBL28294539 0.83 TDP1 (0.45) TSHRCYP1A2ALDH1A1MAPTTHRB
SCHEMBL20210489 0.83 MAPT (0.44) TSHRALDH1A1MAPTPOLBGAA
SCHEMBL18704286 0.83 TDP1 (0.45) TSHRALDH1A1MAPTPOLBGAA
SCHEMBL9493736 0.82 TSHR (0.44) TSHRCYP1A2ALDH1A1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4397672-A1 COMPOUND AND LABELED BIOMATERIAL USING SAME FUJIFILM Corporation (JP) 2024-07-10 EP disclosed
US-20240072809-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-02-29 US disclosed
US-11819551-B2 ASGPR-binding compounds for the degradation of extracellular proteins AVILAR THERAPEUTICS, INC. (US) 2023-11-21 US disclosed
US-20210198305-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF PFIZER INC. 2021-07-01 US disclosed
US-20200190515-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2020-06-18 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 (3 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-11819551-B2 ASGPR-binding compounds for the degradation of extracellular proteins ASGR1, ENGASE, FCGR2A TSHR 645/4885CYP1A2 4379/4885ALDH1A1 3319/4885
US-20200190515-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF RNASE1, RNASEH1, RNASEL TSHR 3308/4885CYP1A2 4860/4885ALDH1A1 3065/4885
US-20210198305-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF RNASE1, RNASEH1, NSUN3 TSHR 3787/4885CYP1A2 4784/4885ALDH1A1 2830/4885

“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.