SCHEMBL23573267

SCHEMBL23573267

CS(=O)(=O)N1CC[C@@H](NC(=O)O)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
ALDH1A1 P00352 3/20 0.48
EPHX2 P34913 3/20 0.46
EPHX1 P07099 1/20 0.46
TSHR P16473 3/20 0.45
LMNA P02545 1/20 0.44
NPY5R Q15761 2/20 0.41
MAPT P10636 1/20 0.41
SMYD3 Q9H7B4 1/20 0.41
POLB P06746 1/20 0.40
CYP2C19 P33261 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL15017224 1.00 TP53 (0.50) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL23573353 1.00 TP53 (0.50) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL2937346 0.89 TP53 (0.58) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL21813427 0.85 TP53 (0.43) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL5568554 0.84 MEN1 (0.38) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL1487329 0.84 MEN1 (0.38) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL1487384 0.84 MEN1 (0.38) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL27905521 0.83 TP53 (0.51) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL20482733 0.80 TSHR (0.44) TP53ALDH1A1EPHX2EPHX1TSHR
SCHEMBL21522684 0.78 TP53 (0.46) TP53ALDH1A1EPHX2EPHX1TSHR

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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-07-01 US disclosed
CN-103167867-A Solid dispersions containing an apoptosis-inducing agent ABBOTT LAB 2013-06-19 CN disclosed
CN-103153993-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBOTT LAB 2013-06-12 CN 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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR ENTPD5, ADORA2A, ENTPD1 TP53 2941/4885ALDH1A1 216/4885EPHX2 959/4885

“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.