SCHEMBL6033040

SCHEMBL6033040

CC(=O)OCC(Br)OC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
TSHR P16473 3/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
HSD17B10 Q99714 1/20 0.40
CHRM1 P11229 3/20 0.35
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
TBXA2R P21731 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
GALR3 O60755 1/20 0.34
BLM P54132 1/20 0.34
CHRM5 P08912 2/20 0.33
CHRM3 P20309 2/20 0.33
PGR P06401 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33

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
SCHEMBL11682599 0.80 TSHR (0.46) TDP1TSHRALDH1A1LMNAHSD17B10
SCHEMBL10391215 0.78 TDP1 (0.54) TDP1TSHRALDH1A1LMNAHSD17B10
SCHEMBL7777034 0.77
SCHEMBL28231114 0.77 TDP1 (0.46) TDP1TSHRALDH1A1LMNAHSD17B10
SCHEMBL8723281 0.75 TDP1 (0.75) TDP1TSHRALDH1A1LMNAHSD17B10
Triacetin SCHEMBL821340 0.75 TDP1 (0.56) TDP1TSHRALDH1A1LMNAHSD17B10
SCHEMBL1079198 0.75 TDP1 (0.56) TDP1TSHRALDH1A1LMNAHSD17B10
SCHEMBL3405450 0.75
SCHEMBL7150206 0.75 TDP1 (0.75) TDP1TSHRALDH1A1LMNAHSD17B10
SCHEMBL12846719 0.75 TDP1 (0.75) TDP1TSHRALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7049285-B2 Biocompatible polymers including peptide spacer BIOPOLYMED INC. (KR) 2006-05-23 US disclosed
US-20030185798-A1 Biocompatible polymers including peptide spacer BIOPOLYMED INC. (KR) 2003-10-02 US disclosed
WO-2003037915-A1 BIOCOMPATIBLE POLYMERS INCLUDING PEPTIDE SPACER BIOPOLYMED INC. (KR) 2003-05-08 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-20030185798-A1 Biocompatible polymers including peptide spacer EEA1, SLC7A1, CD47 TDP1 3553/4885TSHR 2610/4885ALDH1A1 3713/4885

“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.