SCHEMBL9638006

SCHEMBL9638006

CC([C]=O)NC(=O)C(NC(=O)C(N)CCCCN)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 6/20 0.46
DPP8 Q6V1X1 5/20 0.46
DPP9 Q86TI2 5/20 0.46
GNAI3 P08754 1/20 0.43
GNAO1 P09471 1/20 0.43
GNAI1 P63096 1/20 0.43
DPP4 P27487 2/20 0.41
GSR P00390 1/20 0.40
FURIN P09958 1/20 0.36
PCSK6 P29122 1/20 0.36
MMP2 P08253 1/20 0.35
SLC15A1 P46059 1/20 0.35
TERT O14746 3/20 0.34
TLR2 O60603 2/20 0.34
ERAP2 Q6P179 1/20 0.34
CTSL P07711 1/20 0.33

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
SCHEMBL9638018 1.00 DPP7 (0.46) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL9117596 0.91 DPP8 (0.52) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL9117592 0.91 DPP8 (0.52) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL5671395 0.91 DPP8 (0.52) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL10703971 0.87 DPP7 (0.51) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL10182040 0.84 DPP8 (0.47) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL2183058 0.84 DPP8 (0.42) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL28081216 0.82 NMT1 (0.46) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29374543 0.82 GSR (0.49) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29985350 0.82 GSR (0.49) DPP7DPP8DPP9GNAI3GNAO1

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
EP-0268678-B1 NOVEL 5-FLUOROURIDINE COMPOUNDS AND PROCESS FOR THEIR PREPARATION FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-07-29 EP claimed
US-4892939-A ANTITUMOR, ANTIVIRAL AND IMMUNOSUPRESSIVE AGENTS FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-01-09 US claimed
EP-0268678-A1 NOVEL 5-FLUOROURIDINE COMPOUNDS AND PROCESS FOR THEIR PREPARATION FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-06-01 EP claimed