SCHEMBL21087663

SCHEMBL21087663

Nc1cnn(C2CN(C3COC3)C2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 8/20 0.44
MAP3K12 Q12852 8/20 0.37
KAT2B Q92831 1/20 0.35
KCNH2 Q12809 3/20 0.34
HDAC2 Q92769 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
SCHEMBL5021297 0.89 LRRK2 (0.39) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL16985571 0.88 LRRK2 (0.37) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL16985492 0.88 LRRK2 (0.37) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL21850266 0.88 LRRK2 (0.37) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL21850251 0.85 LRRK2 (0.47) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL16975418 0.79 KAT2B (0.35) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL24271370 0.77 LRRK2 (0.42) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL16985433 0.77 LRRK2 (0.53) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL16985407 0.77 LRRK2 (0.53) LRRK2MAP3K12KAT2BKCNH2
SCHEMBL16975542 0.77 LRRK2 (0.53) LRRK2MAP3K12KAT2BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3722298-B1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR OSCOTEC INC (KR) 2023-08-02 EP disclosed
EP-3722298-B1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR OSCOTEC INC (KR) 2023-08-02 EP disclosed
CN-111433208-B Pyrrolo (pyrazolo) pyrimidine derivatives as LRRK2 inhibitors 奥斯考泰克公司 2023-06-30 CN disclosed
US-11370796-B2 Substituted pyrazoles as LRRK2 inhibitors OSCOTEC INC. (KR) 2022-06-28 US disclosed
US-11370796-B2 Substituted pyrazoles as LRRK2 inhibitors OSCOTEC INC. (KR) 2022-06-28 US disclosed
US-20210363144-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR OSCOTEC INC. (KR) 2021-11-25 US disclosed
US-20210363144-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR OSCOTEC INC. (KR) 2021-11-25 US disclosed
EP-3722298-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR Oscotec Inc. (KR) 2020-10-14 EP disclosed
EP-3722298-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR Oscotec Inc. (KR) 2020-10-14 EP disclosed
CN-111433208-A Pyrrolo (pyrazolo) pyrimidine derivatives as L RRK2 inhibitors 奥斯考泰克公司 2020-07-17 CN disclosed
WO-2019112269-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR 주식회사 오스코텍 2019-06-13 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 (2 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-20210363144-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR LRRK2, PARK7, WEE1 LRRK2 1/4885MAP3K12 691/4885KAT2B 4192/4885
US-11370796-B2 Substituted pyrazoles as LRRK2 inhibitors LRRK2, PARK7, PAK3 LRRK2 1/4885MAP3K12 205/4885KAT2B 1505/4885

“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.