SCHEMBL29964324

SCHEMBL29964324

CC(C)(C)OC(=O)N1CCC(Oc2ccc(-c3cc(-c4ccc5c(c4)CCNC5=O)c(N)nc3F)cc2)CC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.38
GSK3B P49841 2/20 0.37
CHEK2 O96017 2/20 0.36
ALK Q9UM73 1/20 0.36
MAPKAPK2 P49137 4/20 0.35
GPR119 Q8TDV5 3/20 0.33
MAPK9 P45984 1/20 0.33
PARP10 Q53GL7 2/20 0.33
PARP11 Q9NR21 2/20 0.33
PARP1 P09874 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32

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
SCHEMBL29965015 0.89 CHEK2 (0.47) MAPK1GSK3BCHEK2ALKGPR119
SCHEMBL29965247 0.85 MAPK1 (0.40) MAPK1GSK3BCHEK2MAPKAPK2GPR119
SCHEMBL29964420 0.84 CHEK2 (0.49) MAPK1GSK3BCHEK2GPR119ALOX5AP
SCHEMBL29964978 0.83 MAPK1 (0.39) MAPK1GSK3BCHEK2MAPKAPK2MAPK9
SCHEMBL29964640 0.83 MAPK1 (0.39) MAPK1GSK3BCHEK2MAPKAPK2MAPK9
SCHEMBL29964708 0.82 MAPK1 (0.47) MAPK1GSK3BCHEK2MAPKAPK2MAPK9
SCHEMBL29964484 0.81 CHEK2 (0.44) MAPK1GSK3BCHEK2MAPKAPK2MAPK9
SCHEMBL29964547 0.81 MAPK1 (0.44) MAPK1GSK3BMAPKAPK2MAPK9PARP10
SCHEMBL29964044 0.81 CHEK2 (0.42) MAPK1CHEK2ALKMAPKAPK2GPR119
SCHEMBL29964262 0.80 MAPK1 (0.45) MAPK1GSK3BGPR119ALOX5APFEN1

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 141/4885GSK3B 1000/4885CHEK2 162/4885

“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.