SCHEMBL22445869

SCHEMBL22445869

Cc1n[nH]c2ccc(NC(=O)c3cc4nn[nH]c4cc3C(F)(F)F)cc12

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.41
▸ JAK1 P23458 5/20 0.41
▸ LRRK2 Q5S007 12/20 0.40
▸ STK17B O94768 1/20 0.37
▸ STK17A Q9UEE5 1/20 0.37
▸ BRAF P15056 1/20 0.37
▸ ULK1 O75385 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
SCHEMBL22445883 0.84 JAK2 (0.44) JAK2JAK1LRRK2ULK1
SCHEMBL24453121 0.82 JAK2 (0.43) JAK2JAK1LRRK2STK17BSTK17A
SCHEMBL22445917 0.79 ULK1 (0.48) JAK2JAK1LRRK2ULK1
SCHEMBL22453724 0.77 LRRK2 (0.41) LRRK2BRAF
SCHEMBL22453882 0.76 LRRK2 (0.55) LRRK2
SCHEMBL22445924 0.75 LRRK2 (0.59) JAK2JAK1LRRK2
SCHEMBL22445853 0.74 JAK2 (0.43) JAK2JAK1LRRK2ULK1
SCHEMBL22445859 0.73 LRRK2 (0.50) LRRK2
SCHEMBL22445940 0.72 LRRK2 (0.43) JAK2JAK1LRRK2ULK1
SCHEMBL18167981 0.71 JAK2 (0.52) JAK2JAK1LRRK2ULK1

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 JAK2 2201/4885JAK1 1985/4885LRRK2 1/4885

“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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