SCHEMBL11530628

SCHEMBL11530628

[CH2]Sc1[nH]nnc1C(N)=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 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
SCHEMBL1342306 0.74
SCHEMBL11778806 0.70
SCHEMBL7313659 0.70 PDPK1 (0.39) PDPK1
SCHEMBL11529909 0.68
SCHEMBL12050686 0.67 HAO1 (0.35) PDPK1
SCHEMBL11526731 0.67 PDPK1 (0.33) PDPK1
SCHEMBL8699118 0.64 PDPK1 (0.35) PDPK1
SCHEMBL28182858 0.64 PDPK1 (0.31) PDPK1
SCHEMBL9218335 0.63 MAPT (0.34) PDPK1
SCHEMBL13512899 0.63 RAB9A (0.34) PDPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4142046-A BACTERICIDES, 7-AMINO-CEPHALOSPORINS SMITHKLINE CORPORATION (US) 1979-02-27 US disclosed
US-4060610-A Pharmaceutical compositions comprising 7-acyl-3-(substituted triazolyl thiomethyl)-cephalosporins and methods of treating bacterial infections SMITHKLINE CORPORATION (US) 1977-11-29 US disclosed
US-3989694-A ANTIBACTERIAL SMITHKLINE CORPORATION (US) 1976-11-02 US disclosed