SCHEMBL22254698

SCHEMBL22254698

CN(C)N1CCN(C(=O)C(C)(C)N)CC1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.33
AGTR2 P50052 1/20 0.32
DPP4 P27487 1/20 0.32
LMNA P02545 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL22254691 0.86 DPP4 (0.32) DPP4
SCHEMBL25540250 0.80 GRM2 (0.36) GRM2AGTR2DPP4LMNACYP2C19
SCHEMBL25530377 0.78 GRM2 (0.35) GRM2AGTR2DPP4LMNACYP2C19
SCHEMBL25530844 0.78 GRM2 (0.35) GRM2AGTR2DPP4LMNACYP2C19
SCHEMBL25530380 0.78 GRM2 (0.35) GRM2AGTR2DPP4LMNACYP2C19
SCHEMBL27607055 0.68 KMT2A (0.33)
SCHEMBL24029615 0.66 MAPT (0.47) DPP4HSD17B10
SCHEMBL22248565 0.66 CHRM1 (0.40) DPP4LMNAHSD17B10
SCHEMBL22255068 0.66 MAPT (0.42) LMNACYP2C19HSD17B10
SCHEMBL22255060 0.66 MAPT (0.42) LMNACYP2C19HSD17B10

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-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed