SCHEMBL21643789

SCHEMBL21643789

C#CCCOCCOCCOCCNC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.34
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 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
SCHEMBL22775016 1.00 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL20574016 0.87 CYP1A2 (0.40) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL26923742 0.87 TSHR (0.39) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL22609473 0.85 TSHR (0.38) MEN1KMT2ATSHRL3MBTL1CYP1A2
SCHEMBL998277 0.85 TSHR (0.48) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL20840269 0.85 TSHR (0.48) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL13738486 0.85 TSHR (0.48) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL13736171 0.85 TSHR (0.48) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL8958401 0.83 MEN1 (0.52) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL9447837 0.83 MEN1 (0.52) SMN1; SMN2MEN1KMT2ALMNAALDH1A1

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-11945786-B2 Compounds, devices, and uses thereof SIGILON THERAPEUTICS, INC. (US) 2024-04-02 US disclosed
US-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. 2020-02-06 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-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SLC10A1, SLCO1B3, SLC5A1 SMN1; SMN2 1100/4885MEN1 272/4885KMT2A 4010/4885
US-11945786-B2 Compounds, devices, and uses thereof SLC10A1, SLCO1B3, SLC5A1 SMN1; SMN2 1100/4885MEN1 272/4885KMT2A 4010/4885

“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.