SCHEMBL22445975

SCHEMBL22445975

Cn1ncc2c(F)c(C(=O)Nc3ccc4[nH]nc(N5Cc6ccccc6C5)c4c3)c(F)cc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.41
▸ LRRK2 Q5S007 6/20 0.41
▸ DYRK1A Q13627 7/20 0.39
▸ GSK3B P49841 5/20 0.39
▸ CLK2 P49760 2/20 0.38
▸ CLK3 P49761 2/20 0.38
▸ WNT1 P04628 1/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ F11 P03951 1/20 0.37
▸ MAOB P27338 1/20 0.36
▸ SYK P43405 1/20 0.36
▸ TYRO3 Q06418 1/20 0.36
▸ FLT3 P36888 1/20 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
SCHEMBL22446036 0.89 LRRK2 (0.49) LRRK2DYRK1AGSK3BCLK2CLK3
SCHEMBL22445969 0.89 LRRK2 (0.51) LRRK2DYRK1AGSK3BCLK2CLK3
SCHEMBL22446055 0.86 LRRK2 (0.40) LRRK2DYRK1AGSK3BCLK2CLK3
SCHEMBL22445974 0.86 LRRK2 (0.42) LRRK2JAK2JAK1F11MAOB
SCHEMBL22445909 0.84 LRRK2 (0.51) LRRK2JAK2JAK1
SCHEMBL22445867 0.83 LRRK2 (0.45) LRRK2JAK2JAK1F11MAOB
SCHEMBL22453952 0.82 LRRK2 (0.53) LRRK2F11MAOB
SCHEMBL22445817 0.82 LRRK2 (0.44) LRRK2DYRK1AGSK3BCLK2CLK3
SCHEMBL22453798 0.82 LRRK2 (0.47) LRRK2DYRK1AWNT1F11
SCHEMBL22446002 0.81 LRRK2 (0.43) LRRK2JAK2JAK1F11MAOB

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 NAMPT 1577/4885LRRK2 1/4885DYRK1A 451/4885

“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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