SCHEMBL27157640

SCHEMBL27157640

CC(C)[C@@H]1CN(c2ccc(-c3cnc(N)c(Cl)n3)cc2)CCO1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 3/20 0.43
▸ ATR Q13535 7/20 0.40
▸ LRRK2 Q5S007 1/20 0.40
▸ CHEK1 O14757 1/20 0.37
▸ SYK P43405 2/20 0.36
▸ FFAR2 O15552 1/20 0.35
▸ NOS1 P29475 2/20 0.35
▸ ABL1 P00519 1/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ YES1 P07947 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ XDH P47989 1/20 0.33
▸ ACVR1 Q04771 1/20 0.33

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
SCHEMBL27157946 1.00 ADK (0.43) ADKATRLRRK2CHEK1SYK
SCHEMBL27157957 1.00 ADK (0.43) ADKATRLRRK2CHEK1SYK
SCHEMBL29914420 0.82 LRRK2 (0.45) LRRK2ACVR1
SCHEMBL24681248 0.82 LRRK2 (0.45) LRRK2ACVR1
SCHEMBL24681249 0.82 LRRK2 (0.45) LRRK2ACVR1
SCHEMBL24681251 0.82 LRRK2 (0.45) LRRK2ACVR1
SCHEMBL27157799 0.80 ADK (0.62) ADKATRLRRK2CHEK1NOS1
SCHEMBL29964018 0.79 LRRK2 (0.37) LRRK2FFAR2
SCHEMBL29964621 0.79 LRRK2 (0.37) LRRK2FFAR2
SCHEMBL27157531 0.76 HRH3 (0.48) ADKLRRK2CHEK1SYKACVR1

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-20240317723-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-09-26 — — US disclosed
EP-4330252-A1 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-117597340-A 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-2022226666-A1 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-20240317723-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) DCK, CMPK1, PHKA1 ADK 64/4885ATR 1024/4885LRRK2 1692/4885

“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.

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