SCHEMBL6832829

SCHEMBL6832829

Cc1ccc(C(=O)OC(C)(C)C(C)[SiH3])s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
DAO P14920 1/20 0.44
POLB P06746 5/20 0.43
HPGD P15428 3/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
RAB9A P51151 2/20 0.38
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
LMNA P02545 2/20 0.36
RECQL P46063 2/20 0.36
TDP1 Q9NUW8 3/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35

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
SCHEMBL4345360 0.80 DAO (0.53) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL6832828 0.75 ALDH1A1 (0.49) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL13747016 0.73 ALDH1A1 (0.56) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL7651751 0.72 DAO (0.61) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL425794 0.70 DAO (0.65) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL8549434 0.68 TSHR (0.44) ALDH1A1DAOHPGDL3MBTL1LMNA
SCHEMBL5246301 0.67
SCHEMBL2659566 0.67 HDAC3 (0.62) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL12744773 0.66 DAO (0.59) ALDH1A1DAOPOLBHPGDCASP3
SCHEMBL13152213 0.66 DAO (0.59) ALDH1A1DAOPOLBHPGDCASP3

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
CN-1646508-A 5-substituted 1, 1-dioxo-1, 2, 5-thiadiazolidin-3-one derivatives as PTP-1B inhibitors NOVARTIS AG (CH) 2005-07-27 CN disclosed
US-20040023974-A1 Cyclic sulfamide derivatives and methods of use COPPOLA GARY MARK 2004-02-05 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 (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-20040023974-A1 Cyclic sulfamide derivatives and methods of use PTPRS, PTPA, PTPMT1 ALDH1A1 2575/4885DAO 3882/4885POLB 2064/4885

“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.