SCHEMBL2783201

SCHEMBL2783201

CC(C)N(C)c1cnc2c(n1)OCCN(C(=O)O)C2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 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
SCHEMBL2784108 0.85 CKS1B (0.37) CKS1BSKP1SKP2
SCHEMBL2110258 0.80 RIPK1 (0.33)
SCHEMBL1326997 0.80 MAPK1 (0.35)
SCHEMBL2781837 0.78
SCHEMBL2783200 0.76 VNN1 (0.37)
SCHEMBL1327054 0.76 PTGER2 (0.36)
SCHEMBL2784105 0.73 VNN1 (0.35)
Hydrochloric Acid SCHEMBL1325848 0.70
SCHEMBL1326966 0.66 MAPT (0.38) CKS1BSKP1SKP2
SCHEMBL3806284 0.62 EDNRB (0.33)

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-2010147226-A1 PYRAZINOOXAZEPINE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-23 WO disclosed