SCHEMBL22540955

SCHEMBL22540955

CCOCc1nc(CC)co1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 1/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
PDE4B Q07343 1/20 0.30

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
SCHEMBL9899819 0.79 P2RX7 (0.33)
SCHEMBL13270562 0.73 ALOX5AP (0.36)
SCHEMBL2046063 0.72
SCHEMBL10711669 0.70 LTA4H (0.46)
SCHEMBL48962 0.69 TAAR1 (0.35) CCNE2CCNE1CDK2
SCHEMBL5535844 0.69 CCNE2 (0.34) CCNE2CCNE1CDK2
SCHEMBL15657546 0.68 CCNE2 (0.33) CCNE2CCNE1CDK2
SCHEMBL13634371 0.67
SCHEMBL680079 0.67
SCHEMBL13550174 0.67 NOS3 (0.34) CCNE2CCNE1CDK2

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-2020209933-A1 IMPROVED INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME UNIVERSITY OF MIAMI (US) 2020-10-15 WO disclosed