SCHEMBL5017599

SCHEMBL5017599

CNCCC(C)NCC(N)=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 1/20 0.35
DPP4 P27487 7/20 0.35
ALDH1A1 P00352 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 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
SCHEMBL7348552 0.81 ALDH1A1 (0.40) DPP4ALDH1A1
SCHEMBL2423251 0.76
SCHEMBL783333 0.76
SCHEMBL18743786 0.74
SCHEMBL23660732 0.72 MAOA (0.36) DPP4MAOAMAOB
SCHEMBL27855767 0.72 ECE1 (0.37) KISS1RDPP4ALDH1A1
SCHEMBL1378572 0.72
SCHEMBL7345987 0.72 ALDH1A1 (0.41) DPP4ALDH1A1
SCHEMBL27327324 0.71
SCHEMBL15389112 0.71 ALDH1A1 (0.42) DPP4ALDH1A1

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
EP-1648905-B1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBOTT LAB (US) 2008-12-31 EP disclosed