SCHEMBL9275232

SCHEMBL9275232

CCCP(=O)(O)Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccc(Br)nc3C(=O)NC)n2)c(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 11/20 0.50
▸ PTK2 Q05397 2/20 0.48
▸ JAK2 O60674 1/20 0.48
▸ NTRK1 P04629 1/20 0.48
▸ TYK2 P29597 1/20 0.48
▸ KDR P35968 1/20 0.48
▸ JAK3 P52333 1/20 0.48
▸ PTK2B Q14289 1/20 0.48
▸ NTRK3 Q16288 1/20 0.48
▸ NTRK2 Q16620 1/20 0.48
▸ ALK Q9UM73 7/20 0.47

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
SCHEMBL9277650 0.94 LRRK2 (0.51) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9279742 0.92 LRRK2 (0.51) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9276955 0.92 LRRK2 (0.51) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9277106 0.92 LRRK2 (0.51) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9273876 0.89 LRRK2 (0.51) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9276144 0.89 LRRK2 (0.49) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9280420 0.88 PTK2 (0.52) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9273889 0.87 LRRK2 (0.48) LRRK2PTK2JAK2NTRK1TYK2
SCHEMBL9281228 0.86 ALK (0.54) LRRK2ALK
SCHEMBL9277522 0.85 ALK (0.49) LRRK2ALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2646448-B1 MACROCYCLIC KINASE INHIBITORS OSI PHARMACEUTICALS LLC (US) 2017-08-30 — — EP disclosed
US-9133224-B2 Macrocyclic kinase inhibitors OSI Pharmaceuticals, LLC (US) 2015-09-15 — — US disclosed
EP-2646448-A1 MACROCYCLIC KINASE INHIBITORS OSI Pharmaceuticals, LLC (US) 2013-10-09 — — EP disclosed
US-20130261086-A1 MACROCYCLIC KINASE INHIBITORS OSI Pharmaceuticals, LLC (US) 2013-10-03 — — US disclosed
WO-2012074951-A1 MACROCYCLIC KINASE INHIBITORS OSI Pharmaceuticals, LLC (US) 2012-06-07 — — 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-20130261086-A1 MACROCYCLIC KINASE INHIBITORS PTK2, SRC, PTK2B LRRK2 707/4885PTK2 1/4885JAK2 4/4885

“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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