SCHEMBL16102966

SCHEMBL16102966

CCOC(=O)c1cc2n(c1)CCCN(C(=O)OCc1cc(Cl)cc(Cl)c1)C2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 14/20 0.40
▸ MAPT P10636 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ RAB9A P51151 3/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ATXN2 Q99700 6/20 0.37

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
SCHEMBL16101883 0.94 MAPT (0.41) ENPP2MAPTPKMATXN2
SCHEMBL16099740 0.91 ENPP2 (0.43) ENPP2MAPTPKMALDH1A1SMN1; SMN2
SCHEMBL16099892 0.87 ENPP2 (0.43) ENPP2ATXN2
SCHEMBL16100076 0.85 TACR1 (0.43) ENPP2MAPTRAB9ANPC1ALDH1A1
SCHEMBL16103041 0.79 ENPP2 (0.42) ENPP2
SCHEMBL16103009 0.79 ENPP2 (0.45) ENPP2ATXN2
SCHEMBL17509128 0.76 ENPP2 (0.45) ENPP2RAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL16100215 0.76 ENPP2 (0.39) ENPP2RAB9ANPC1SMN1; SMN2ATXN2
SCHEMBL16101200 0.75 ENPP2 (0.42) ENPP2ATXN2
SCHEMBL16099886 0.74 ENPP2 (0.42) ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970302-A1 S1P AND/OR ATX MODULATING AGENTS Biogen MA Inc. (US) 2016-01-20 — — EP claimed
WO-2014152725-A1 S1P AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2014-09-25 — — WO claimed
US-20160039825-A1 S1P AND/OR ATX MODULATING AGENTS BIOGEN MA INC. 2016-02-11 — — US disclosed
EP-2970302-A1 S1P AND/OR ATX MODULATING AGENTS Biogen MA Inc. (US) 2016-01-20 — — EP disclosed
WO-2014152725-A1 S1P AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2014-09-25 — — 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-20160039825-A1 S1P AND/OR ATX MODULATING AGENTS ENPP2, S1PR1, S1PR2 ENPP2 1/4885MAPT 3910/4885PKM 3852/4885

“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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