SCHEMBL24096063

SCHEMBL24096063

CSc1ncc2c(n1)CN(C1CCOC1)C2=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 2/20 0.37
▸ IL4I1 Q96RQ9 1/20 0.35
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ IRAK4 Q9NWZ3 3/20 0.33
▸ HTR2A P28223 2/20 0.32
▸ CCNA2 P20248 1/20 0.32
▸ CDK2 P24941 1/20 0.32
▸ DRD2 P14416 1/20 0.31
▸ DRD1 P21728 1/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ MAOA P21397 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ LRRK2 Q5S007 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 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
SCHEMBL30272126 1.00 GABRA1 (0.37) GABRA1IL4I1GABRG2GABRB3GABRA5
SCHEMBL24096237 0.93 GABRA1 (0.42) GABRA1IRAK4HTR2ACCNA2CDK2
SCHEMBL30272086 0.93 GABRA1 (0.42) GABRA1IRAK4HTR2ACCNA2CDK2
SCHEMBL24096167 0.90 LRRK2 (0.36) GABRA1HTR2ACCNA2CDK2DRD2
SCHEMBL30272111 0.88 GABRG2 (0.44) IL4I1GABRG2GABRB3GABRA5KCNH2
SCHEMBL24096404 0.88 GABRG2 (0.44) IL4I1GABRG2GABRB3GABRA5KCNH2
SCHEMBL30272123 0.86 MAOA (0.39) GABRA1HTR2ACCNA2CDK2DRD2
SCHEMBL24096151 0.86 MAOA (0.39) GABRA1HTR2ACCNA2CDK2DRD2
SCHEMBL24096299 0.81 CCNA2 (0.39) GABRG2GABRB3GABRA5KCNH2CCNA2
SCHEMBL30272103 0.81 CCNA2 (0.39) GABRG2GABRB3GABRA5KCNH2CCNA2

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-20230123268-A1 AMINO-PYRIMIDINE CYCLO-AMIDES HOFFMANN-LA ROCHE INC. (US) 2023-04-20 — — US disclosed
WO-2021249904-A2 AMINO-PYRIMIDINE CYCLO-AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2021-12-16 — — 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-20230123268-A1 AMINO-PYRIMIDINE CYCLO-AMIDES ATXN2, ATXN2L, ATXN10 GABRA1 2627/4885IL4I1 163/4885GABRG2 3009/4885

“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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