SCHEMBL22955221

SCHEMBL22955221

CC1CCCN1C(=O)C(NC(=O)CCCCN)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.37
DPP8 Q6V1X1 6/20 0.37
DPP9 Q86TI2 5/20 0.37
DPP7 Q9UHL4 4/20 0.37
FAP Q12884 3/20 0.37
NMT1 P30419 5/20 0.34
NMT2 O60551 4/20 0.34
ITGB3 P05106 4/20 0.34
ITGA2B P08514 4/20 0.34

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
SCHEMBL23986272 0.87 ACE (0.33) DPP4DPP8DPP9DPP7FAP
SCHEMBL23986731 0.87 ACE (0.33) DPP4DPP8DPP9DPP7FAP
SCHEMBL23810140 0.87 ACE (0.38) DPP4DPP8DPP9DPP7FAP
SCHEMBL26854776 0.86 HRH3 (0.35)
SCHEMBL24327205 0.85 ACE (0.37) DPP4
SCHEMBL25510029 0.84 DPP4 (0.34) DPP4DPP8DPP9DPP7FAP
SCHEMBL23766218 0.84 ITGB3 (0.34) ITGB3ITGA2B
SCHEMBL24047853 0.82 ELANE (0.37) DPP4DPP8DPP9DPP7FAP
SCHEMBL22105668 0.82 DPP7 (0.33) DPP4DPP8DPP9DPP7FAP
SCHEMBL18754696 0.80 DPP4 (0.35) DPP4DPP8DPP9DPP7FAP

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-2021018118-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 1 PROTEINS JANSSEN PHARMACEUTICA NV (BE) 2021-02-04 WO disclosed