SCHEMBL27159697

SCHEMBL27159697

COCCN(C)Cc1cc(B2OC(C)(C)C(C)(C)O2)ccc1C1CCOCC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.33
KCNH2 Q12809 2/20 0.33
BACE1 P56817 2/20 0.32
ROCK1 Q13464 1/20 0.31
HIF1A Q16665 1/20 0.31
LPL P06858 2/20 0.31
LIPG Q9Y5X9 2/20 0.31
LTA4H P09960 1/20 0.31
PIK3CA P42336 1/20 0.31
OPRL1 P41146 1/20 0.31
MTOR P42345 1/20 0.31
NTSR1 P30989 1/20 0.30
PDCD1 Q15116 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
SCHEMBL27159651 0.85 LIPG (0.36) BACE1ROCK1HIF1ALPLLIPG
SCHEMBL29914775 0.84 LIPG (0.36) ROCK1HIF1ALPLLIPG
SCHEMBL22820460 0.84 LIPG (0.36) ROCK1HIF1ALPLLIPG
Hydrochloric Acid SCHEMBL27159968 0.83 LIPG (0.35) ROCK1HIF1ALPLLIPG
SCHEMBL27159888 0.82 PIK3CA (0.37) BACE1ROCK1PIK3CAMTOR
SCHEMBL27159748 0.80 CNR1 (0.36) CNR1KCNH2LTA4HPIK3CAMTOR
SCHEMBL27159633 0.74 BACE1 (0.36) BACE1ROCK1HIF1ALPLLIPG
SCHEMBL29914800 0.74 BACE1 (0.36) BACE1ROCK1HIF1ALPLLIPG
SCHEMBL27160169 0.74 LIPG (0.39) ROCK1HIF1ALPLLIPGOPRL1
SCHEMBL27159737 0.74 OPRL1 (0.39) HIF1ALPLLIPGOPRL1

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 4 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
CN-117597336-A Halogen substituted amino aza-heteroaryl compounds as inhibitors of hematopoietic progenitor kinase 1 (HPK 1) 安大略省癌症研究所(OICR) 2024-02-23 CN 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 CNR1 3121/4885KCNH2 3586/4885BACE1 4652/4885

“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.