SCHEMBL16985290

SCHEMBL16985290

Nc1cnn(C2CCOCC2)c1C1CC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.39
PIK3CD O00329 9/20 0.37
PDE4D Q08499 2/20 0.36
RET P07949 1/20 0.36
ALOX15 P16050 1/20 0.34
PDE1C Q14123 4/20 0.34
PDE1A P54750 3/20 0.34
PDE1B Q01064 3/20 0.34
PDE9A O76083 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
SCHEMBL7886968 0.81 ALOX15 (0.44) PIK3CDPDE4DALOX15PDE1CPDE1A
SCHEMBL5021081 0.78 LRRK2 (0.43) LRRK2PDE4DALOX15PDE1CPDE1A
SCHEMBL5021106 0.78 PDE4D (0.43) LRRK2PIK3CDPDE4DRETALOX15
SCHEMBL25018458 0.76 LRRK2 (0.42) LRRK2PDE4DPDE1CPDE1APDE1B
SCHEMBL16985276 0.75 LRRK2 (0.38) LRRK2PDE4DPDE1CPDE1APDE1B
SCHEMBL2523176 0.75 PDE1B (0.34) PDE1CPDE1APDE1B
SCHEMBL28577114 0.74 PDE4D (0.43) LRRK2PIK3CDPDE4DALOX15PDE1C
SCHEMBL16985254 0.74 PDE4D (0.40) PDE4DALOX15PDE1CPDE1APDE1B
SCHEMBL28655584 0.73 S1PR1 (0.39) LRRK2PIK3CDPDE4DPDE1CPDE1A
SCHEMBL31613162 0.72 PIK3CD (0.47) LRRK2PIK3CDPDE4DPDE1CPDE1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183217-A1 INHIBITORS OF LRRK2 KINASE HALIA THERAPEUTICS INC (US) 2023-06-15 US disclosed
US-20230183217-A1 INHIBITORS OF LRRK2 KINASE HALIA THERAPEUTICS INC (US) 2023-06-15 US disclosed
US-11578061-B2 Inhibitors of LRRK2 kinase Halia Therapeutics, Inc. (US) 2023-02-14 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-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
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 (4 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 LRRK2 1/4885PIK3CD 871/4885PDE4D 2789/4885
US-20230183217-A1 INHIBITORS OF LRRK2 KINASE LRRK2, SNCA, PRKAR2B LRRK2 1/4885PIK3CD 633/4885PDE4D 944/4885
US-11578061-B2 Inhibitors of LRRK2 kinase LRRK2, SNCA, PRKAR2B LRRK2 1/4885PIK3CD 633/4885PDE4D 944/4885
US-20170015668-A1 COMPOUNDS LRRK2, PARK7, PINK1 LRRK2 1/4885PIK3CD 807/4885PDE4D 2463/4885

“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.