SCHEMBL11565634

SCHEMBL11565634

C=CCN(CC=C)S(=O)(=O)c1ncn(C(=O)N(CC)CC)n1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.50
KDM4E B2RXH2 3/20 0.38
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 3/20 0.33
LMNA P02545 2/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33
PKM P14618 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
RAB9A P51151 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
SCHEMBL11557480 0.96 DPP4 (0.49) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11560668 0.96 DPP4 (0.52) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11564107 0.93 DPP4 (0.47) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11565704 0.93 DPP4 (0.47) DPP4KDM4EPOLBTDP1RAB9A
SCHEMBL11559127 0.92 DPP4 (0.57) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11561990 0.92 DPP4 (0.48) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11565900 0.91 DPP4 (0.54) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11562054 0.91 DPP4 (0.52) DPP4KDM4EPOLBTDP1MEN1
SCHEMBL11564595 0.91 DPP4 (0.48) DPP4KDM4EPOLBTDP1HTT
SCHEMBL11562091 0.91 DPP4 (0.45) DPP4KDM4EPOLBTDP1HTT

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