SCHEMBL26658644

SCHEMBL26658644

CCC(=O)NC(CNC(=O)C(C)C)CC(=O)NC

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.34
LMNA P02545 1/20 0.31
POLB P06746 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
SCHEMBL26659398 0.90 MMP2 (0.31) CYP2C9
SCHEMBL26658674 0.83
SCHEMBL26658332 0.78 MCL1 (0.33)
SCHEMBL26658359 0.75 CYP2D6 (0.41) LMNA
SCHEMBL25542496 0.73 CYP2C9 (0.38) CYP2C9
SCHEMBL26658336 0.69 PSMB5 (0.39)
SCHEMBL11923594 0.67 ALDH1A1 (0.40) CYP2C9LMNA
SCHEMBL26658439 0.66 MTNR1A (0.36) CYP2C9
SCHEMBL17680117 0.66 CYP2D6 (0.39) CYP2C9LMNA
SCHEMBL17919842 0.65 CYP2C9 (0.45) CYP2C9

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
US-11802211-B2 Polymeric dyes and uses thereof BECTON, DICKINSON AND COMPANY (US) 2023-10-31 US disclosed