SCHEMBL3908464

SCHEMBL3908464

CCN(N)C(=O)COc1c(C(=O)OC)sc(Br)c1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.46
KMT2A Q03164 5/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 2/20 0.35
HSD17B10 Q99714 3/20 0.34
TSHR P16473 2/20 0.34
HTT P42858 1/20 0.32
KDM4E B2RXH2 3/20 0.32
CYP1A2 P05177 1/20 0.32
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
GAA P10253 2/20 0.31
PTPRC P08575 1/20 0.31
PTPN2 P17706 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL3911917 0.80 PTPN1 (0.49) PTPN1KMT2AMAPTALDH1A1MEN1
SCHEMBL3906716 0.79 PTPN1 (0.71) PTPN1KMT2AMAPTHSD17B10TSHR
SCHEMBL13867918 0.79 PTPN1 (0.54) PTPN1KMT2AMAPTALDH1A1MEN1
SCHEMBL6266995 0.79 PTPN1 (0.45) PTPN1KMT2AMAPTALDH1A1MEN1
SCHEMBL3912303 0.77 PTPN1 (0.39) PTPN1KMT2AMAPTHSD17B10TSHR
SCHEMBL3908457 0.74 PTPN1 (0.46) PTPN1KMT2AMAPTALDH1A1MEN1
SCHEMBL3908332 0.74 PTPN1 (0.48) PTPN1KMT2AMAPTALDH1A1MEN1
SCHEMBL3906530 0.74 PTPN1 (0.48) PTPN1KMT2AMAPTMEN1HSD17B10
SCHEMBL3908251 0.74 PTPN1 (0.48) PTPN1KMT2AMAPTALDH1A1MEN1
SCHEMBL2682770 0.72 MAPT (0.48) PTPN1KMT2AMAPTALDH1A1MEN1

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-7521473-B2 Inhibitors of protein tyrosine phosphatase 1B WYETH (US) 2009-04-21 US disclosed
US-20050203087-A1 Inhibitors of protein tyrosine phosphatase 1B WYETH 2005-09-15 US disclosed
WO-2005081954-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 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-20050203087-A1 Inhibitors of protein tyrosine phosphatase 1B PTPRO, PTPRS, PTPRM PTPN1 11/4885KMT2A 2996/4885MAPT 3976/4885

“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.