SCHEMBL6921269

SCHEMBL6921269

CC(C)(C)[C@H](NC(=O)Nc1ccc(N2CCCC2)c(F)c1)C(=O)N(CC(=O)NO)CC1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 15/20 0.46
KDM4E B2RXH2 1/20 0.38
PRNP P04156 1/20 0.37
S1PR1 P21453 1/20 0.37
MTTP P55157 2/20 0.37

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
SCHEMBL6825423 0.94 S1PR1 (0.44) NPY2RKDM4ES1PR1
SCHEMBL6822141 0.90 RAB9A (0.42) NPY2R
SCHEMBL6923744 0.87 MAPT (0.37) NPY2R
SCHEMBL6822378 0.85 MAPT (0.37)
SCHEMBL6825450 0.85 KLK7 (0.40)
SCHEMBL6923640 0.85 ALDH1A1 (0.48) KDM4E
SCHEMBL6825276 0.84 MEN1 (0.43)
SCHEMBL6822392 0.83 SLC6A9 (0.41)
SCHEMBL6825220 0.83 KMT2A (0.42)
SCHEMBL7064641 0.82 NPY2R (0.41) NPY2RKDM4EPRNPS1PR1MTTP

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-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed