SCHEMBL29964452

SCHEMBL29964452

Nc1nc(F)c(-c2cnn(C3CCOCC3)c2)cc1-c1ccc2c(c1)CCNC2=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.55
▸ ALK Q9UM73 2/20 0.41
▸ EML4 Q9HC35 1/20 0.40
▸ PARP10 Q53GL7 2/20 0.39
▸ PARP11 Q9NR21 2/20 0.39
▸ MAPKAPK2 P49137 4/20 0.39
▸ MET P08581 3/20 0.39
▸ JAK2 O60674 4/20 0.39
▸ MAPK9 P45984 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ MAP4K3 Q8IVH8 3/20 0.38
▸ BRAF P15056 1/20 0.38
▸ MAPK3 P27361 1/20 0.38
▸ TBK1 Q9UHD2 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
SCHEMBL29964765 0.85 MAPK1 (0.65) MAPK1METJAK2JAK1JAK3
SCHEMBL31079103 0.81 PARP10 (0.55) MAPK1PARP10PARP11MAPKAPK2MAPK9
SCHEMBL29964696 0.81 MAPK1 (0.58) MAPK1PARP10PARP11MAPKAPK2MAPK9
SCHEMBL29964732 0.79 MAPK1 (0.52) MAPK1PARP10PARP11MAPKAPK2MAPK9
SCHEMBL29964239 0.79 MAPK1 (0.52) MAPK1PARP10PARP11MAPKAPK2MAPK9
SCHEMBL29964240 0.79 MAPK1 (0.48) MAPK1PARP10PARP11MAPKAPK2MAPK9
SCHEMBL29964252 0.78 ACVRL1 (0.42) MET
SCHEMBL31079059 0.77 MAPK1 (0.49) MAPK1PARP10PARP11MAPKAPK2JAK2
SCHEMBL29965006 0.77 MAPK1 (0.49) MAPK1PARP10PARP11MAPKAPK2MAPK9
SCHEMBL31079357 0.76 MAPK1 (0.47) MAPK1PARP10PARP11MAPKAPK2MAPK9

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 MAPK1 141/4885ALK 1520/4885EML4 1358/4885

“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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