SCHEMBL18040314

SCHEMBL18040314

O=C1C(N2CCOCC2)=CCCN1c1ccc(/N=[N+](\[O-])c2ccc(N3CCC=C(N4CCOCC4)C3=O)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ CYP1B1 Q16678 1/20 0.36
▸ AKR1C3 P42330 1/20 0.35
▸ MITF O75030 1/20 0.34
▸ MAPK1 P28482 3/20 0.34
▸ TDP1 Q9NUW8 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PKM P14618 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL18040317 1.00 MAPT (0.37) MAPTKDM4EGAABLMCYP1B1
SCHEMBL20709642 0.92 MAPT (0.32) MAPTKDM4EGAABLMCYP1B1
SCHEMBL18058766 0.87 AKR1C3 (0.32) MAPTKDM4EGAABLMCYP1B1
SCHEMBL1995413 0.85 MAPT (0.50) MAPTKDM4EGAABLMAKR1C3
SCHEMBL18058748 0.84 GSK3B (0.39) —
SCHEMBL20694863 0.84 GSK3B (0.39) —
SCHEMBL18058838 0.83 MEN1 (0.36) MAPTKDM4EBLMMEN1KMT2A
SCHEMBL18058759 0.82 S100A4 (0.34) MAPTBLMMEN1KMT2AALDH1A1
SCHEMBL15731795 0.79 PIK3R1 (0.39) MAPTKDM4EGAAMAPK1TDP1
SCHEMBL20102796 0.78 NR3C2 (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3280714-B1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM FIS FABBRICA ITALIANA SINTETICI SPA (IT) 2019-02-06 — — EP claimed
US-20180118737-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2018-05-03 — — US claimed
EP-3064497-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S.- Fabbrica Italiana Sintetici S.p.A. (IT) 2016-09-07 — — EP claimed
US-10590133-B2 Dimer impurities of Apixaban and method to remove them F.I.S.-FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2020-03-17 — — US disclosed
US-10385049-B2 Dimer impurities of apixaban and method to remove them F.I.S.—Fabbrica Italiana Sintetici S.p.A. (IT) 2019-08-20 — — US disclosed
US-10385049-B2 Dimer impurities of apixaban and method to remove them F.I.S.—Fabbrica Italiana Sintetici S.p.A. (IT) 2019-08-20 — — US disclosed
EP-3280714-B1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM FIS FABBRICA ITALIANA SINTETICI SPA (IT) 2019-02-06 — — EP disclosed
EP-3280714-B1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM FIS FABBRICA ITALIANA SINTETICI SPA (IT) 2019-02-06 — — EP disclosed
US-20180118737-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2018-05-03 — — US disclosed
US-20180118737-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2018-05-03 — — US disclosed
US-20180118737-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2018-05-03 — — US disclosed
EP-3280714-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. Fabbrica Italiana Sintetici S.p.A. (IT) 2018-02-14 — — EP disclosed
WO-2017013079-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2017-01-26 — — WO disclosed
WO-2017013079-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2017-01-26 — — WO disclosed
EP-3064497-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S.- Fabbrica Italiana Sintetici S.p.A. (IT) 2016-09-07 — — EP disclosed
EP-3064497-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F.I.S.- Fabbrica Italiana Sintetici S.p.A. (IT) 2016-09-07 — — 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 (3 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-10590133-B2 Dimer impurities of Apixaban and method to remove them F2, FGB, F8 MAPT 4678/4885KDM4E 4104/4885GAA 2707/4885
US-10385049-B2 Dimer impurities of apixaban and method to remove them F2, FGB, F8 MAPT 4678/4885KDM4E 4104/4885GAA 2707/4885
US-20180118737-A1 DIMER IMPURITIES OF APIXABAN AND METHOD TO REMOVE THEM F2, FGB, F8 MAPT 4678/4885KDM4E 4104/4885GAA 2707/4885

“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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