SCHEMBL29914811

SCHEMBL29914811

COCCN(C)Cc1cc(-c2nc(-c3cc4c(cc3F)C(=O)NCC4)c(N)nc2F)ccc1C1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 13/20 0.39
MTOR P42345 1/20 0.34
CNR1 P21554 2/20 0.33
KCNH2 Q12809 2/20 0.33
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
CD274 Q9NZQ7 1/20 0.31
MAPKAPK2 P49137 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
SCHEMBL27159793 0.92 MAPK1 (0.46) MAPK1MTORCNR1KCNH2GABRG2
SCHEMBL27159959 0.91 MAPK1 (0.41) MAPK1GABRG2GABRB3GABRA5
SCHEMBL27159885 0.91 MAPK1 (0.42) MAPK1KCNH2GABRG2GABRB3GABRA5
SCHEMBL31079277 0.90 MAPK1 (0.41) MAPK1MTORCNR1KCNH2GABRG2
SCHEMBL31310881 0.88 MTOR (0.37) MAPK1MTORGABRG2GABRB3GABRA5
SCHEMBL29914902 0.88 MAPK1 (0.36) MAPK1MTOR
SCHEMBL29964814 0.84 MAPK1 (0.50) MAPK1MTORCNR1KCNH2GABRG2
SCHEMBL27159896 0.84 MAPK1 (0.39) MAPK1GABRG2GABRB3GABRA5CD274
SCHEMBL27159735 0.84 MAPK1 (0.45) MAPK1GABRG2GABRB3GABRA5CD274
SCHEMBL29163322 0.84 MAPK1 (0.38) MAPK1CNR1KCNH2GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240425479-A1 HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-12-26 US disclosed
EP-4330246-A1 HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) Ontario Institute for Cancer Research (OICR) (CA) 2024-03-06 EP disclosed
WO-2022226665-A1 HALO-SUBSTITUTED AMINO AZA-HETEROARYL 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-20240425479-A1 HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) DCK, CMPK1, WNK1 MAPK1 420/4885MTOR 794/4885CNR1 3121/4885

“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.