SCHEMBL16985277

SCHEMBL16985277

Cc1c(N)cnn1C1CCCOC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 4/20 0.39
JAK2 O60674 2/20 0.39
LRRK2 Q5S007 4/20 0.36
FLT3 P36888 2/20 0.36
MAP3K1 Q13233 2/20 0.36
PI4KB Q9UBF8 2/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
ALOX15 P16050 1/20 0.35
PIK3R1 P27986 3/20 0.34
PIK3CA P42336 3/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE1C Q14123 1/20 0.33
TTK P33981 2/20 0.32
PRKDC P78527 2/20 0.32
KDM4C Q9H3R0 1/20 0.32

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
SCHEMBL5021101 0.91 LRRK2 (0.39) LRRK2FLT3MAP3K1PI4KBALOX15
SCHEMBL28563034 0.91 LRRK2 (0.39) LRRK2FLT3MAP3K1PI4KBALOX15
SCHEMBL4561032 0.84 LRRK2 (0.40) JAK1JAK2LRRK2ALOX15TYK2
SCHEMBL5021081 0.81 LRRK2 (0.43) LRRK2ALOX15PDE1APDE1BPDE1C
SCHEMBL16975520 0.79 KAT2B (0.43) LRRK2ALOX15PIK3CAKCNH2
SCHEMBL16975519 0.79 KAT2B (0.43) LRRK2ALOX15PIK3CAKCNH2
SCHEMBL16975536 0.79 KAT2B (0.43) LRRK2ALOX15PIK3CAKCNH2
SCHEMBL23275182 0.78 ALOX15 (0.47) LRRK2ALDH1A1LMNAPOLBALOX15
SCHEMBL5021135 0.78 LRRK2 (0.47) LRRK2ALOX15KCNH2
SCHEMBL16985307 0.76 JAK1 (0.35) JAK1JAK2LRRK2FLT3MAP3K1

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 11 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-10618901-B2 LRRK2 inhibitors for the treatment of Parkinson's disease GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-04-14 US disclosed
EP-3099695-B1 COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-04-08 EP 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-20170015668-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-01-19 US disclosed
US-20170015668-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-01-19 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
WO-2015113452-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-08-06 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 (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-10618901-B2 LRRK2 inhibitors for the treatment of Parkinson's disease LRRK2, PARK7, PINK1 JAK1 2234/4885JAK2 2646/4885LRRK2 1/4885
US-20150259340-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK JAK1 100/4885JAK2 60/4885LRRK2 1/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK JAK1 55/4885JAK2 48/4885LRRK2 1/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK JAK1 100/4885JAK2 60/4885LRRK2 1/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK JAK1 70/4885JAK2 37/4885LRRK2 1/4885
US-20170015668-A1 COMPOUNDS LRRK2, PARK7, PINK1 JAK1 2968/4885JAK2 3076/4885LRRK2 1/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK JAK1 70/4885JAK2 37/4885LRRK2 1/4885

“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.