SCHEMBL3170018

SCHEMBL3170018

CCC(=O)C1=C(C)OC(C)(C)OC1=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.37
▸ FASN P49327 3/20 0.37
▸ ACP1 P24666 2/20 0.37
▸ CDC25B P30305 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ LMNA P02545 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ KDM4E B2RXH2 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
SCHEMBL11743094 0.81 FASN (0.40) PTPN1FASNACP1CDC25BALDH1A1
SCHEMBL7428431 0.68 PTPN1 (0.37) PTPN1ACP1CDC25BALDH1A1LMNA
SCHEMBL11742802 0.68 PTPN1 (0.41) PTPN1FASNACP1CDC25BALDH1A1
SCHEMBL21996373 0.67 PTPN1 (0.39) PTPN1ACP1CDC25BALDH1A1L3MBTL1
SCHEMBL10572506 0.66 PTPN1 (0.40) PTPN1ACP1CDC25BALDH1A1L3MBTL1
SCHEMBL1356857 0.64 PTPN1 (0.62) PTPN1ACP1CDC25BALDH1A1L3MBTL1
SCHEMBL9730908 0.64 — —
SCHEMBL30457001 0.63 ALDH1A1 (0.38) PTPN1ACP1CDC25BALDH1A1L3MBTL1
SCHEMBL10519639 0.63 PTPN1 (0.38) PTPN1ACP1CDC25BALDH1A1L3MBTL1
SCHEMBL8306149 0.63 PTPN1 (0.38) PTPN1ACP1CDC25BALDH1A1L3MBTL1

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-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors TORRENT PHARMACEUTICALS LTD. (IN) 2010-01-14 — — US disclosed
EP-1996588-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS Torrent Pharmaceuticals Ltd (IN) 2008-12-03 — — EP disclosed
WO-2007100295-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS TORRENT PHARMACEUTICALS LTD (IN) 2007-09-07 — — 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-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors EDNRA, EDNRB, AGTR1 PTPN1 2381/4885FASN 2375/4885ACP1 2874/4885

“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.

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