SCHEMBL22445871

SCHEMBL22445871

Cn1cc(-c2n[nH]c3ccc(NC(=O)c4c(F)cc5c(cnn5C)c4F)cc23)cn1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 9/20 0.51
▸ LRRK2 Q5S007 2/20 0.49
▸ NTRK1 P04629 2/20 0.47
▸ NTRK2 Q16620 1/20 0.47
▸ GSK3B P49841 6/20 0.46
▸ DYRK1A Q13627 6/20 0.46
▸ CLK2 P49760 1/20 0.46
▸ CLK3 P49761 1/20 0.46
▸ MAPK1 P28482 1/20 0.43

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
SCHEMBL22453170 0.90 LRRK2 (0.56) AXLLRRK2NTRK1NTRK2GSK3B
SCHEMBL22445909 0.89 LRRK2 (0.51) AXLLRRK2
SCHEMBL22445823 0.89 LRRK2 (0.51) LRRK2
SCHEMBL22453166 0.88 LRRK2 (0.51) LRRK2
SCHEMBL22445852 0.87 LRRK2 (0.51) LRRK2NTRK1DYRK1ACLK2CLK3
SCHEMBL22453184 0.87 LRRK2 (0.49) LRRK2
SCHEMBL22453917 0.86 LRRK2 (0.45) LRRK2GSK3BDYRK1A
SCHEMBL22453129 0.86 LRRK2 (0.51) LRRK2
SCHEMBL22445849 0.86 LRRK2 (0.56) LRRK2NTRK1
SCHEMBL22445874 0.86 LRRK2 (0.49) LRRK2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 — — WO claimed
US-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2022-05-26 — — US disclosed
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 — — WO disclosed
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 — — 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-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, PINK1 AXL 3001/4885LRRK2 1/4885NTRK1 1496/4885

“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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