SCHEMBL29964621

SCHEMBL29964621

CC(C)[C@H]1CN(c2ccc(-c3cnc(N)c(Cl)c3F)cc2)CCO1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.37
▸ MET P08581 3/20 0.36
▸ ALK Q9UM73 1/20 0.35
▸ FFAR2 O15552 1/20 0.35
▸ JAK2 O60674 1/20 0.34
▸ CDK8 P49336 4/20 0.34
▸ CDK19 Q9BWU1 4/20 0.34
▸ BTK Q06187 1/20 0.34
▸ DGAT1 O75907 1/20 0.34
▸ FYN P06241 3/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ CCNC P24863 3/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ RPS6KA3 P51812 1/20 0.33
▸ TGFBR1 P36897 1/20 0.31

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
SCHEMBL29964018 1.00 LRRK2 (0.37) LRRK2METALKFFAR2JAK2
SCHEMBL29965161 0.87 DGAT1 (0.37) LRRK2METALKFFAR2DGAT1
SCHEMBL29964665 0.87 DGAT1 (0.37) LRRK2METALKFFAR2DGAT1
SCHEMBL31079362 0.81 CNR2 (0.50) LRRK2METJAK2BTKFYN
SCHEMBL24681251 0.80 LRRK2 (0.45) LRRK2METJAK2FYNCNR2
SCHEMBL24681248 0.80 LRRK2 (0.45) LRRK2METJAK2FYNCNR2
SCHEMBL24681249 0.80 LRRK2 (0.45) LRRK2METJAK2FYNCNR2
SCHEMBL29914420 0.80 LRRK2 (0.45) LRRK2METJAK2FYNCNR2
SCHEMBL29964218 0.80 DGAT1 (0.35) LRRK2METALKFFAR2JAK2
SCHEMBL29964581 0.80 DGAT1 (0.35) LRRK2METALKFFAR2JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-10-17 — — US disclosed
WO-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — 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-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) CMPK1, WNK1, AAK1 LRRK2 1274/4885MET 852/4885ALK 1520/4885

“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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