SCHEMBL25315216

SCHEMBL25315216

C[C@@H]1C[C@H](C#N)CN1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 1/20 0.32
MAPT P10636 1/20 0.31
TSHR P16473 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
SCHEMBL25310191 1.00 KDM2B (0.32) KDM2BMAPTTSHR
SCHEMBL22633315 1.00 KDM2B (0.32) KDM2BMAPTTSHR
SCHEMBL599421 0.83 MAPT (0.34) KDM2BMAPTTSHR
SCHEMBL599420 0.83 MAPT (0.34) KDM2BMAPTTSHR
SCHEMBL599422 0.83 MAPT (0.34) KDM2BMAPTTSHR
SCHEMBL15920668 0.82 MAPT (0.36) MAPTTSHR
SCHEMBL3563797 0.81 KDM2B (0.33) KDM2B
SCHEMBL22029860 0.77 ATM (0.39)
SCHEMBL21196005 0.77 ATM (0.39)
SCHEMBL6592886 0.77 ATM (0.39)

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-2023139085-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-07-27 WO disclosed