SCHEMBL6288288

SCHEMBL6288288

COc1ccc(C(=O)C(CC(C)=O)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
LMNA P02545 4/20 0.64
MITF O75030 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
HIF1A Q16665 1/20 0.64
MAPT P10636 4/20 0.58
HTT P42858 1/20 0.58
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
POLB P06746 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
CES2 O00748 1/20 0.51
CES1 P23141 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP1A2 P05177 1/20 0.49
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47

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
SCHEMBL1372720 0.91 ALDH1A1 (0.64) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL11526496 0.88 L3MBTL1 (0.65) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL1989880 0.87 LMNA (0.56) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL5114421 0.86 LMNA (0.69) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL1375091 0.85 LMNA (0.57) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL29110194 0.84 L3MBTL1 (0.71) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL15158382 0.84 L3MBTL1 (0.48) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL11733684 0.83 NTSR1 (0.56) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL2922282 0.81 MITF (0.59) ALDH1A1LMNAMITFSMN1; SMN2HIF1A
SCHEMBL16624899 0.79 ALDH1A1 (0.54) ALDH1A1LMNAMITFSMN1; SMN2HIF1A

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 ALDH1A1 2470/4885LMNA 4447/4885MITF 3694/4885

“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.