SCHEMBL16985357

SCHEMBL16985357

Nc1cnn([C@H]2CCN(C3COC3)C[C@@H]2F)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 6/20 0.53
DYRK1A Q13627 4/20 0.49
KCNH2 Q12809 4/20 0.42
KAT2B Q92831 1/20 0.36
MAP3K12 Q12852 5/20 0.36

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
SCHEMBL16975542 1.00 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985433 1.00 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985407 1.00 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL21958470 0.86 LRRK2 (0.54) LRRK2DYRK1AKCNH2KAT2B
SCHEMBL24271370 0.85 LRRK2 (0.42) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL21610987 0.85 LRRK2 (0.55) LRRK2DYRK1AKCNH2KAT2B
SCHEMBL21821365 0.85 LRRK2 (0.46) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985343 0.85 LRRK2 (0.46) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL21938979 0.84 LRRK2 (0.42) LRRK2DYRK1AKCNH2
SCHEMBL21954900 0.82 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12

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-20220119371-A1 COMPOUND, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. (US) 2022-04-21 US disclosed
US-11214565-B2 Compound, compositions, and methods DENALI THERAPEUTICS INC. (US) 2022-01-04 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-20180327391-A1 COMPOUND, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. 2018-11-15 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
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 (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-10618901-B2 LRRK2 inhibitors for the treatment of Parkinson's disease LRRK2, PARK7, PINK1 LRRK2 1/4885DYRK1A 1061/4885KCNH2 3594/4885
US-20180327391-A1 COMPOUND, COMPOSITIONS, AND METHODS LRRK2, PARK7, MAPT LRRK2 1/4885DYRK1A 795/4885KCNH2 2999/4885
US-20220119371-A1 COMPOUND, COMPOSITIONS, AND METHODS LRRK2, PARK7, SNCA LRRK2 1/4885DYRK1A 767/4885KCNH2 3011/4885
US-11214565-B2 Compound, compositions, and methods LRRK2, PARK7, MAPT LRRK2 1/4885DYRK1A 795/4885KCNH2 2999/4885
US-20170015668-A1 COMPOUNDS LRRK2, PARK7, PINK1 LRRK2 1/4885DYRK1A 2308/4885KCNH2 3477/4885

“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.