SCHEMBL13423765

SCHEMBL13423765

CCC(=O)C1(O)CCNC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 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
SCHEMBL12286788 0.88
SCHEMBL22504466 0.82
SCHEMBL1855601 0.78
SCHEMBL24690290 0.76
Hydrochloric Acid SCHEMBL11546148 0.76 HTR2A (0.34)
SCHEMBL24690294 0.76
SCHEMBL11995755 0.76
SCHEMBL8380436 0.74
SCHEMBL6915421 0.72 CYP1A2 (0.33) KDM4EKMT2A
SCHEMBL29604700 0.71

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-2010042851-A1 ANTIBACTERIAL AMINOGLYCOSIDE ANALOGS ACHAOGEN, INC. (US) 2010-04-15 WO disclosed