SCHEMBL11053995

SCHEMBL11053995

CC(N)C(=O)NC(C(=O)O)C1CC(O)NC1=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.33
CTRB1 P17538 3/20 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
SCHEMBL11048470 1.00 DPP4 (0.33) DPP4CTRB1
SCHEMBL11049674 0.76 CTRB1 (0.33) DPP4CTRB1
Bromide SCHEMBL11047216 0.75 CTRB1 (0.33) DPP4CTRB1
SCHEMBL13116555 0.74 ENO1 (0.33) DPP4CTRB1
Hydrochloric Acid SCHEMBL3842489 0.67 DPP4 (0.41) DPP4CTRB1
SCHEMBL159552 0.60 DPP4 (0.52) DPP4CTRB1
SCHEMBL159553 0.60 DPP4 (0.52) DPP4CTRB1
SCHEMBL380600 0.60 DPP4 (0.52) DPP4CTRB1
SCHEMBL476353 0.60 DPP4 (0.52) DPP4CTRB1
SCHEMBL380599 0.60 DPP4 (0.52) DPP4CTRB1

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-4465844-A PEPTIDE, GERMICIDE, DISINFECTANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-08-14 US disclosed
US-4465844-A PEPTIDE, GERMICIDE, DISINFECTANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-08-14 US disclosed
US-4436918-A FROM A 2,5-DIOXOPYRROLIDINE COMPOUND TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-03-13 US disclosed