SCHEMBL14320302

SCHEMBL14320302

Nc1ccc(N2CCOCC2)c(OCCO)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ GAA P10253 3/20 0.55
▸ PIK3CA P42336 4/20 0.44
▸ PIK3R1 P27986 3/20 0.44
▸ MTOR P42345 1/20 0.44
▸ BRAF P15056 1/20 0.43
▸ PIK3CD O00329 2/20 0.42
▸ PIK3CB P42338 2/20 0.42
▸ LGMN Q99538 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ SCD O00767 1/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ CCR5 P51681 1/20 0.39
▸ POLB P06746 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ THRB P10828 1/20 0.38

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
SCHEMBL25196556 0.91 SMN1; SMN2 (0.51) MAPTSMN1; SMN2GAAPIK3CAPIK3R1
SCHEMBL30376114 0.91 SMN1; SMN2 (0.51) MAPTSMN1; SMN2GAAPIK3CAPIK3R1
SCHEMBL30019224 0.84 MAPT (0.52) MAPTGAAALDH1A1KDM4ELMNA
SCHEMBL13723948 0.84 GAA (0.54) MAPTSMN1; SMN2GAAPIK3CAPIK3R1
SCHEMBL20631337 0.84 MAPT (0.54) MAPTSMN1; SMN2GAAPIK3CAPIK3R1
SCHEMBL20344872 0.83 SYK (0.52) MAPTSMN1; SMN2GAAPIK3CAMTOR
SCHEMBL12527305 0.83 GAA (0.52) MAPTSMN1; SMN2GAAPIK3CAPIK3R1
Hydrochloric Acid SCHEMBL5014134 0.83 MAPT (0.52) MAPTSMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL13244145 0.83 MAPT (0.49) MAPTSMN1; SMN2GAABRAFALDH1A1
SCHEMBL13723923 0.82 SMN1; SMN2 (0.58) MAPTSMN1; SMN2GAABRAFALDH1A1

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 13 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-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 MAPT 470/4885SMN1; SMN2 882/4885GAA 742/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK MAPT 501/4885SMN1; SMN2 835/4885GAA 940/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK MAPT 470/4885SMN1; SMN2 882/4885GAA 742/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK MAPT 470/4885SMN1; SMN2 882/4885GAA 742/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 MAPT 634/4885SMN1; SMN2 609/4885GAA 499/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK MAPT 438/4885SMN1; SMN2 986/4885GAA 698/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK MAPT 438/4885SMN1; SMN2 986/4885GAA 698/4885

“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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