SCHEMBL29964744

SCHEMBL29964744

CN(C)Cc1cc(-c2cc(-c3cc4c(cc3F)C(=O)NCC4)c(N)nc2F)ccc1N1CCN(C2CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
MAPKAPK2 P49137 1/20 0.32
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 0.31
ALK Q9UM73 2/20 0.31
KDR P35968 1/20 0.31
CDC7 O00311 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL31079348 0.97 ALK (0.33) MAPK1MAPKAPK2ALKKDR
SCHEMBL31079041 0.97 ALK (0.34) MAPK1MAPKAPK2ALKKDRCDC7
SCHEMBL31079216 0.92 MAPK1 (0.40) MAPK1MAPKAPK2ALK
SCHEMBL29964555 0.90 CDK4 (0.37) MAPK1MAPKAPK2FEN1CD274
SCHEMBL29964362 0.89 MAPK1 (0.39) MAPK1MAPKAPK2ALKKDR
SCHEMBL29965127 0.89 MAPK1 (0.39) MAPK1MAPKAPK2ALKKDRCDC7
SCHEMBL31078997 0.89 MAPKAPK2 (0.33) MAPKAPK2CD274
SCHEMBL31079254 0.89 MAPK1 (0.36) MAPK1MAPKAPK2ALOX5APFEN1CD274
SCHEMBL31079364 0.88 PIK3CD (0.33) MAPKAPK2ALOX5APFEN1CD274
SCHEMBL31079433 0.86 PDE3B (0.35) MAPK1MAPKAPK2ALOX5APFEN1CD274

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 141/4885MAPKAPK2 79/4885ALOX5AP 4225/4885

“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.