SCHEMBL14320462

SCHEMBL14320462

N#CCC(=O)N1CCN(c2nc(N)ncc2F)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 3/20 0.46
▸ MTOR P42345 1/20 0.46
▸ PIK3R1 P27986 2/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HRH4 Q9H3N8 1/20 0.38
▸ JAK3 P52333 6/20 0.38
▸ JAK2 O60674 4/20 0.38
▸ JAK1 P23458 2/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ SYK P43405 1/20 0.36
▸ PI4KB Q9UBF8 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35

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
SCHEMBL13723870 0.80 HRH4 (0.44) PIK3CAMTORKDM4EALDH1A1MAPT
SCHEMBL13724547 0.78 DRD2 (0.41) PIK3CAMTORKMT2A
SCHEMBL1041464 0.74 SYK (0.58) JAK3JAK2JAK1TYK2SYK
SCHEMBL15651808 0.71 SYK (0.50) PIK3CAMTORKDM4EALDH1A1MAPT
SCHEMBL13724439 0.70 FFAR4 (0.37) PIK3CAMTORKDM4EHRH4SMN1; SMN2
SCHEMBL31406852 0.69 KMT2A (0.68) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL13732517 0.69 PDE10A (0.41) PIK3CAMTORPIK3R1KDM4EHRH4
SCHEMBL14541937 0.68 KDM4E (0.69) PIK3CAMTORPIK3R1KDM4EALDH1A1
SCHEMBL13724424 0.68 HRH3 (0.49) KDM4EALDH1A1MAPTHRH4SMN1; SMN2
SCHEMBL14417884 0.68 KDM4E (0.54) PIK3CAMTORKDM4EALDH1A1MAPT

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 14 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-9802937-B2 Substituted pyrazolo{4,3-D}pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-10-31 — — US disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 — — US disclosed
US-9499535-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2016-11-22 — — US disclosed
EP-2699572-B1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2016-08-10 — — EP disclosed
EP-2699579-B1 PYRAZOLO[4,3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-10-07 — — EP 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
WO-2014060113-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 — — WO disclosed
WO-2014060112-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 — — WO disclosed
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 — — US disclosed
US-20120329780-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 — — 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 (7 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 PIK3CA 1016/4885MTOR 327/4885PIK3R1 1064/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK PIK3CA 410/4885MTOR 291/4885PIK3R1 1181/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK PIK3CA 1016/4885MTOR 327/4885PIK3R1 1064/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK PIK3CA 1016/4885MTOR 327/4885PIK3R1 1064/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 PIK3CA 1018/4885MTOR 300/4885PIK3R1 810/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK PIK3CA 846/4885MTOR 293/4885PIK3R1 877/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK PIK3CA 846/4885MTOR 293/4885PIK3R1 877/4885

“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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