SCHEMBL21391581

SCHEMBL21391581

CCC(OC(CO)[C@@H](C)O)[C@@H](O)CO

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL19522171 1.00 TSHR (0.33) TSHRTDP1LMNAL3MBTL1
SCHEMBL16924994 0.91 TSHR (0.33) TSHRTDP1LMNAL3MBTL1
SCHEMBL2303494 0.89 TSHR (0.41) TSHRTDP1LMNAL3MBTL1
SCHEMBL20893308 0.78 TSHR (0.45) TSHRTDP1LMNA
SCHEMBL19592300 0.77 TDP1 (0.35) TSHRTDP1LMNAL3MBTL1
SCHEMBL19277005 0.77 TDP1 (0.35) TSHRTDP1LMNAL3MBTL1
SCHEMBL18934170 0.77 TDP1 (0.35) TSHRTDP1LMNAL3MBTL1
SCHEMBL15966302 0.77 TDP1 (0.35) TSHRTDP1LMNAL3MBTL1
SCHEMBL16079082 0.77 TDP1 (0.35) TSHRTDP1LMNAL3MBTL1
SCHEMBL20143360 0.77 TDP1 (0.35) TSHRTDP1LMNAL3MBTL1

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-10660974-B2 Chemiluminescent probes for diagnostics and in vivo imaging RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2020-05-26 US disclosed
US-20190290787-A1 CHEMILUMINESCENT PROBES FOR DIAGNOSTICS AND IN VIVO IMAGING RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2019-09-26 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-10660974-B2 Chemiluminescent probes for diagnostics and in vivo imaging DAXX, DCAF15, DCAF1 TSHR 1960/4885TDP1 1151/4885LMNA 669/4885
US-20190290787-A1 CHEMILUMINESCENT PROBES FOR DIAGNOSTICS AND IN VIVO IMAGING DAXX, DCAF15, DCAF1 TSHR 1960/4885TDP1 1151/4885LMNA 669/4885

“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.