SCHEMBL11564356

SCHEMBL11564356

C=CCN(CC=C)C(=O)n1cnc(S(=O)(=O)N(CC)CCCCCC)n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.49
TSHR P16473 1/20 0.33
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 1/20 0.30
CNR2 P34972 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL11563757 0.99 DPP4 (0.50) DPP4TSHRALDH1A1LMNASMN1; SMN2
SCHEMBL11564001 0.96 DPP4 (0.49) DPP4ALDH1A1LMNAKDM4EZDHHC20
SCHEMBL11562952 0.96 DPP4 (0.51) DPP4TSHRALDH1A1LMNASMN1; SMN2
SCHEMBL11563733 0.95 DPP4 (0.48) DPP4SMN1; SMN2ZDHHC20ZDHHC2CNR2
SCHEMBL11563528 0.95 DPP4 (0.46) DPP4TSHRZDHHC20ZDHHC2CNR2
SCHEMBL11565403 0.94 DPP4 (0.47) DPP4TSHRZDHHC20ZDHHC2
SCHEMBL11564882 0.94 DPP4 (0.49) DPP4ALDH1A1SMN1; SMN2MAPT
SCHEMBL11556889 0.93 DPP4 (0.46) DPP4LMNAKDM4EZDHHC20ZDHHC2
SCHEMBL11562752 0.92 DPP4 (0.52) DPP4TSHRSMN1; SMN2KDM4EMAPT
SCHEMBL11559537 0.92 DPP4 (0.52) DPP4TSHRALDH1A1LMNASMN1; SMN2

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
US-4148626-A Herbicidal agents THE BOOTS COMPANY LIMITED (GB) 1979-04-10 US disclosed