SCHEMBL29964189

SCHEMBL29964189

COC1(c2ccc(-c3cc(-c4ccc5c(c4)CCNC5=O)c(N)nc3F)cc2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 4/20 0.37
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
GPR119 Q8TDV5 4/20 0.36
GSK3B P49841 1/20 0.35
ROCK2 O75116 2/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
MAPK1 P28482 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CCND3 P30281 1/20 0.35
CDK6 Q00534 1/20 0.35
CTSD P07339 1/20 0.34
CTSE P14091 1/20 0.34
BACE1 P56817 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
PARP10 Q53GL7 2/20 0.34
PARP11 Q9NR21 2/20 0.34

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
SCHEMBL29964361 0.91 JAK2 (0.37) MAPKAPK2JAK2JAK1GPR119GSK3B
SCHEMBL29964714 0.91 JAK2 (0.39) MAPKAPK2JAK2JAK1GPR119GSK3B
SCHEMBL29964575 0.86 MAPKAPK2 (0.37) MAPKAPK2JAK2JAK1GPR119GSK3B
SCHEMBL29964997 0.86 RET (0.40) MAPKAPK2GPR119GSK3BMAPK1CDK4
SCHEMBL29964188 0.85 MAPKAPK2 (0.41) MAPKAPK2MAPK1CDK4CCND1CCND3
SCHEMBL29963854 0.85 GPR119 (0.52) JAK2JAK1GPR119MAPK1
SCHEMBL29964606 0.84 PARP10 (0.41) MAPKAPK2MAPK1CDK4CCND1CCND3
SCHEMBL29964262 0.84 MAPK1 (0.45) JAK2GPR119GSK3BALOX5APFEN1
SCHEMBL31079181 0.83 CDK9 (0.42) JAK1
SCHEMBL29964258 0.83 NR1H2 (0.50) MAPKAPK2GPR119GSK3BROCK2ALOX5AP

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 MAPKAPK2 79/4885JAK2 333/4885JAK1 241/4885

“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.