SCHEMBL15565705

SCHEMBL15565705

CCOC(=O)C1CCN(Cc2ccc3c(OC4CCC(CC)CC4)cccc3c2)CC1

nearest known ligand 0.83

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.83
ALDH1A1 P00352 4/20 0.55
KDM4E B2RXH2 4/20 0.55
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
CCR8 P51685 1/20 0.53
S1PR5 Q9H228 1/20 0.52

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
SCHEMBL15564373 1.00 ENPP2 (0.83) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL15564750 1.00 ENPP2 (0.83) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL20953370 0.92 ENPP2 (0.81) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL15565341 0.92 ENPP2 (0.81) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL15565343 0.92 ENPP2 (0.81) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL15565017 0.91 ENPP2 (1.00) ENPP2S1PR5
SCHEMBL15565330 0.91 ENPP2 (1.00) ENPP2S1PR5
SCHEMBL15565015 0.91 ENPP2 (1.00) ENPP2S1PR5
SCHEMBL20953406 0.89 ENPP2 (0.68) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL16912968 0.89 ENPP2 (0.82) ENPP2ALDH1A1KDM4EMAPTSMN1; SMN2

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
US-10273234-B2 Compounds that are S1P modulating agents and/or ATX modulating agents BIOGEN MA INC. (US) 2019-04-30 US disclosed
EP-2879674-B1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN MA INC (US) 2017-11-22 EP disclosed
US-20150203493-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2015-07-23 US disclosed
EP-2879674-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS Biogen MA Inc. (US) 2015-06-10 EP disclosed
WO-2014025708-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2014-02-13 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 (2 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-10273234-B2 Compounds that are S1P modulating agents and/or ATX modulating agents ENPP2, S1PR1, S1PR2 ENPP2 1/4885ALDH1A1 4016/4885KDM4E 3070/4885
US-20150203493-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS ENPP2, S1PR1, S1PR2 ENPP2 1/4885ALDH1A1 4016/4885KDM4E 3070/4885

“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.