SCHEMBL4706111

SCHEMBL4706111

O=S(=O)(O)CCc1ccc(Cl)cn1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ DAO P14920 1/20 0.37
▸ NFE2L2 Q16236 2/20 0.36
▸ PTK2 Q05397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ TRPA1 O75762 1/20 0.34

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
SCHEMBL4704270 0.84 APLNR (0.44) KDM4EPOLBRAB9AL3MBTL1DAO
SCHEMBL22811326 0.82 KDM4E (0.38) KDM4EPOLBRAB9AL3MBTL1DAO
SCHEMBL8847221 0.80 HTR2A (0.41) KDM4ERAB9AL3MBTL1TDP1LMNA
SCHEMBL31419101 0.79 HTR2A (0.33) TDP1LMNA
SCHEMBL20188502 0.79 ALDH1A1 (0.39) KDM4ERAB9ALMNATSHR
SCHEMBL19551005 0.76 APLNR (0.47) KDM4EPOLBRAB9AL3MBTL1NFE2L2
SCHEMBL4705324 0.75 MAOB (0.40) L3MBTL1DAOPTK2MAOBTDP1
SCHEMBL510846 0.74 — —
SCHEMBL20168848 0.74 APLNR (0.46) KDM4EPOLBRAB9AL3MBTL1NFE2L2
SCHEMBL24867307 0.73 FFAR1 (0.55) KDM4EL3MBTL1PTK2LMNATSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567489-B1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LTD (GB) 2008-07-23 — — EP disclosed
US-20060166985-A1 Pyrrolydin-2-one derivatives as inhibitors of thrombin and factor xa GLAXO GROUP LIMITED (GB) 2006-07-27 — — US disclosed
EP-1567489-A1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LIMITED (GB) 2005-08-31 — — EP disclosed
WO-2004052851-A1 PYRROLYDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LIMITED (GB) 2004-06-24 — — 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-20060166985-A1 Pyrrolydin-2-one derivatives as inhibitors of thrombin and factor xa TFPI, TFPI2, SERPINC1 KDM4E 3068/4885POLB 2515/4885RAB9A 2040/4885

“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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