SCHEMBL19975480

SCHEMBL19975480

NC(=O)CC(NC(=O)C1(C(N)=O)CC1)c1nc(-c2cc(F)ccc2F)no1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.40
DPP7 Q9UHL4 4/20 0.40
S1PR1 P21453 7/20 0.34
DCAF1 Q9Y4B6 1/20 0.33
S1PR3 Q99500 1/20 0.32
CTSA P10619 1/20 0.32
MET P08581 2/20 0.32
GABRA5 P31644 1/20 0.32
VSIR Q9H7M9 2/20 0.32
CD274 Q9NZQ7 1/20 0.32
HDAC4 P56524 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
SCHEMBL19975478 1.00 DPP4 (0.40) DPP4DPP7S1PR1DCAF1S1PR3
SCHEMBL19981240 0.79 LMNA (0.40) S1PR1DCAF1S1PR3CTSA
SCHEMBL19981159 0.77 DPP4 (0.38) DPP4DPP7S1PR1
SCHEMBL19981353 0.77 MAPT (0.43) S1PR1S1PR3
SCHEMBL18078016 0.77 DPP4 (0.45) DPP4DPP7S1PR1CTSA
SCHEMBL19867093 0.77 CD274 (0.58) DPP4DPP7S1PR1CTSAGABRA5
SCHEMBL18077936 0.77 CD274 (0.58) DPP4DPP7S1PR1CTSAGABRA5
SCHEMBL24218473 0.73 S1PR1 (0.35) DPP4DPP7S1PR1DCAF1S1PR3
SCHEMBL19981133 0.73 DPP4 (0.36) DPP4DPP7S1PR1DCAF1S1PR3
SCHEMBL19981143 0.73 DPP4 (0.34) DPP4DPP7S1PR1CTSA

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-2018051254-A1 CYCLIC SUBSTITUTED-1,2,4-OXADIAZOLE COMPOUNDS AS IMMUNOMODULATORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-03-22 WO disclosed