SCHEMBL17573299

SCHEMBL17573299

Oc1ccc2cnn(-c3cc(N4CCOCC4)ncn3)c2c1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 18/20 0.70
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
EGLN2 Q96KS0 1/20 0.45
EGLN1 Q9GZT9 1/20 0.45
EGLN3 Q9H6Z9 1/20 0.45

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
SCHEMBL17573369 0.82 LRRK2 (1.00) LRRK2EGLN2EGLN1EGLN3
SCHEMBL17573286 0.81 LRRK2 (0.70) LRRK2
SCHEMBL17573300 0.80 LRRK2 (1.00) LRRK2
SCHEMBL17573378 0.79 LRRK2 (1.00) LRRK2
SCHEMBL17573292 0.79 LRRK2 (1.00) LRRK2
SCHEMBL17573293 0.78 LRRK2 (1.00) LRRK2
SCHEMBL18399207 0.78 LRRK2 (0.86) LRRK2
SCHEMBL18399160 0.78 LRRK2 (0.86) LRRK2
SCHEMBL17573365 0.77 LRRK2 (0.58) LRRK2
SCHEMBL18399251 0.76 LRRK2 (0.58) LRRK2HTTSMN1; SMN2EGLN2EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3190889-B1 COMPOUNDS INHIBITING LEUCINE-RICH REPEAT KINASE ENZYME ACTIVITY MERCK SHARP & DOHME (US) 2021-11-17 EP disclosed
US-10954240-B2 Compounds inhibiting leucine-rich repeat kinase enzyme activity MERCK SHARP & DOHME CORP. (US) 2021-03-23 US disclosed
WO-2016036586-A1 COMPOUNDS INHIBITING LEUCINE-RICH REPEAT KINASE ENZYME ACTIVITY MERCK SHARP & DOHME CORP. (US) 2016-03-10 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 (1 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-10954240-B2 Compounds inhibiting leucine-rich repeat kinase enzyme activity LRRK2, LRRC59, LRRC47 LRRK2 1/4885HTT 407/4885SMN1; SMN2 907/4885

“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.