SCHEMBL6284396

SCHEMBL6284396

CCCCCCCc1ccc(OCCCn2c(C)ccc2-c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.45
HRH3 Q9Y5N1 2/20 0.44
BCHE P06276 2/20 0.44
HSD11B1 P28845 1/20 0.44
LTA4H P09960 1/20 0.43
EPHX2 P34913 1/20 0.43
MGLL Q99685 2/20 0.43
BACE1 P56817 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLCO1B3 Q9NPD5 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42

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
SCHEMBL6279317 1.00 PTPN1 (0.48) PTPN1L3MBTL1HRH3BCHEHSD11B1
SCHEMBL6286274 1.00 PTPN1 (0.48) PTPN1L3MBTL1HRH3BCHEHSD11B1
SCHEMBL6278803 0.99 PTPN1 (0.46) PTPN1L3MBTL1HRH3BCHEHSD11B1
SCHEMBL6285790 0.96 PTPN1 (0.46) PTPN1HRH3BCHEHSD11B1LTA4H
SCHEMBL6283361 0.96 PTPN1 (0.49) PTPN1HRH3BCHEHSD11B1LTA4H
SCHEMBL6285256 0.96 PTPN1 (0.49) PTPN1HRH3BCHEHSD11B1LTA4H
SCHEMBL6284001 0.96 BCHE (0.46) PTPN1L3MBTL1HRH3BCHEHSD11B1
SCHEMBL6282846 0.95 PTPN1 (0.48) PTPN1HRH3BCHEHSD11B1LTA4H
SCHEMBL6286719 0.94 PTPN1 (0.49) PTPN1HRH3BCHEHSD11B1LTA4H
SCHEMBL6278914 0.93 PTPN1 (0.44) PTPN1HRH3BCHELTA4HEPHX2

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-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM PTPN1 2/4885L3MBTL1 1502/4885HRH3 1166/4885

“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.