SCHEMBL31361722

SCHEMBL31361722

CN1CCC(n2cc(N)cn2)C(O)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.37
ALOX15 P16050 1/20 0.34
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAP4K1 Q92918 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
SCHEMBL16975393 0.82 IRAK4 (0.40) KDM5AALOX15GAASMN1; SMN2
SCHEMBL31361720 0.79 KDM5A (0.36) KDM5AJAK2JAK1TYK2JAK3
SCHEMBL9953033 0.78 KDM5A (0.47) KDM5AALOX15GAASMN1; SMN2
SCHEMBL23685815 0.78 KDM5A (0.47) KDM5AALOX15GAASMN1; SMN2
SCHEMBL31361718 0.78 KDM5A (0.47) KDM5AALOX15GAASMN1; SMN2
SCHEMBL15650297 0.78 JAK2 (0.41) KDM5AJAK2JAK1TYK2JAK3
SCHEMBL31361694 0.77 ALDH1A1 (0.39) GAA
SCHEMBL216558 0.74 ALOX15 (0.50) KDM5AALOX15GAASMN1; SMN2
Hydrochloric Acid SCHEMBL15145595 0.73 ALOX15 (0.49) KDM5AALOX15GAASMN1; SMN2
SCHEMBL17076683 0.73 KDM5A (0.43) KDM5AALOX15GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025017116-A1 PHARMACEUTICAL COMPOUNDS HAVING ACTIVITY AS WEE1 INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2025-01-23 WO disclosed