SCHEMBL6288440

SCHEMBL6288440

CC(C)(C)OC(=O)C([O])Cc1c[nH]c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
KDM4E B2RXH2 2/20 0.56
POLB P06746 2/20 0.56
APAF1 O14727 1/20 0.56
RECQL P46063 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
TACR1 P25103 2/20 0.55
CTSL P07711 2/20 0.54
CTSS P25774 1/20 0.54
CTSK P43235 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
MEN1 O00255 2/20 0.52
LMNA P02545 2/20 0.52
KMT2A Q03164 2/20 0.52
MPO P05164 1/20 0.52
TSHR P16473 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
HIF1A Q16665 1/20 0.52
TP53 P04637 1/20 0.52

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
SCHEMBL29498785 0.86 MAPT (0.65) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL594511 0.86 MAPT (0.65) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL21309637 0.86 MAPT (0.65) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL30406357 0.86 MAPT (0.65) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL7775097 0.86 MAPT (0.65) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL6286138 0.85 MEN1 (0.60) MAPTKDM4EPOLBAPAF1RECQL
Hydrochloric Acid SCHEMBL3954521 0.85 MAPT (0.64) MAPTKDM4EPOLBAPAF1RECQL
Hydrochloric Acid SCHEMBL7690928 0.85 MAPT (0.64) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL6284343 0.84 PKM (0.64) MAPTKDM4EPOLBAPAF1RECQL
SCHEMBL27382605 0.84 MAPT (0.55) MAPTKDM4EPOLBAPAF1RECQL

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 MAPT 4800/4885KDM4E 171/4885POLB 3295/4885

“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.