SCHEMBL17076755

SCHEMBL17076755

Nc1cnn(C2CCN(C3COC3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 6/20 0.42
▸ KDM5A P29375 1/20 0.40
▸ KIT P10721 1/20 0.39
▸ BMPR1A P36894 1/20 0.36
▸ ACVRL1 P37023 1/20 0.36
▸ ACVR1 Q04771 1/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ MAP3K12 Q12852 10/20 0.34
▸ OGA O60502 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
SCHEMBL20476125 0.91 KDM5A (0.44) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL15652781 0.91 KDM5A (0.44) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL15652780 0.91 KDM5A (0.44) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL15134755 0.87 KDM5A (0.41) LRRK2KDM5ABMPR1AACVRL1ACVR1
SCHEMBL10191777 0.86 IRAK4 (0.38) LRRK2KDM5A
SCHEMBL2574462 0.85 KIT (0.48) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL15650936 0.84 KIT (0.40) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL17076925 0.82 KDM5A (0.40) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL17076926 0.82 KDM5A (0.40) LRRK2KDM5AKITBMPR1AACVRL1
SCHEMBL15244353 0.81 ALOX15 (0.45) KDM5ABMPR1AACVRL1ACVR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 — — US disclosed
US-20180305356-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2018-10-25 — — US disclosed
US-10000482-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2018-06-19 — — US disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 — — US disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 — — US disclosed
US-20150259340-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-17 — — US 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 (5 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-20150259340-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK LRRK2 1/4885KDM5A 2286/4885KIT 377/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK LRRK2 1/4885KDM5A 1963/4885KIT 288/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK LRRK2 1/4885KDM5A 2286/4885KIT 377/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK LRRK2 1/4885KDM5A 2123/4885KIT 345/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK LRRK2 1/4885KDM5A 2123/4885KIT 345/4885

“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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