SCHEMBL17135932

SCHEMBL17135932

CC(Nc1c(C#N)nnc2cc(-c3ccncc3)ccc12)c1cccnc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 14/20 0.67
▸ KDM4E B2RXH2 1/20 0.40
▸ EGFR P00533 2/20 0.39
▸ PRKDC P78527 2/20 0.39
▸ VNN1 O95497 1/20 0.39
▸ LATS1 O95835 1/20 0.37
▸ AAK1 Q2M2I8 1/20 0.37

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
SCHEMBL14059810 0.91 LRRK2 (0.65) LRRK2EGFRPRKDCLATS1AAK1
SCHEMBL17135925 0.91 LRRK2 (0.65) LRRK2EGFRPRKDCLATS1AAK1
SCHEMBL14059811 0.91 LRRK2 (0.65) LRRK2EGFRPRKDCLATS1AAK1
SCHEMBL14059965 0.84 LRRK2 (0.71) LRRK2
SCHEMBL14059542 0.82 LRRK2 (0.64) LRRK2
SCHEMBL17135911 0.80 LRRK2 (1.00) LRRK2
SCHEMBL14059734 0.78 LRRK2 (0.63) LRRK2LATS1AAK1
SCHEMBL17135956 0.78 LRRK2 (0.74) LRRK2
SCHEMBL17135957 0.78 LRRK2 (0.74) LRRK2
SCHEMBL14062231 0.77 LRRK2 (0.77) LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9884828-B2 Substituted cinnolines as inhibitors of LRRK2 kinase activity IMAGO PHARMACEUTICALS, INC. (US) 2018-02-06 — — US claimed
US-20150284337-A1 INHIBITORS OF LRRK2 KINASE ACTIVITY ELAN PHARMACEUTICALS, INC. (US) 2015-10-08 — — US claimed
CN-103917525-A Inhibitors of LRRK2 kinase activity ELAN PHARM INC 2014-07-09 — — CN claimed
US-9884828-B2 Substituted cinnolines as inhibitors of LRRK2 kinase activity IMAGO PHARMACEUTICALS, INC. (US) 2018-02-06 — — US disclosed
CN-103917525-B The inhibitor of LRRK2 kinase activity 依兰制药公司 2016-08-17 — — CN disclosed
US-20150284337-A1 INHIBITORS OF LRRK2 KINASE ACTIVITY ELAN PHARMACEUTICALS, INC. (US) 2015-10-08 — — US disclosed
CN-103917525-A Inhibitors of LRRK2 kinase activity ELAN PHARM INC 2014-07-09 — — CN 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-20150284337-A1 INHIBITORS OF LRRK2 KINASE ACTIVITY LRRK2, PARK7, PINK1 LRRK2 1/4885KDM4E 1167/4885EGFR 752/4885

“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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