SCHEMBL14997484

SCHEMBL14997484

O=C(CS)N1CC[C@@H](O)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.44
DPP7 Q9UHL4 2/20 0.44
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
CHRM1 P11229 2/20 0.40
GRIN2B Q13224 1/20 0.37
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
CPN1 P15169 1/20 0.34
CPB2 Q96IY4 1/20 0.34
CHRM3 P20309 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ADAM10 O14672 1/20 0.33
ERBB2 P04626 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
SCHEMBL14619086 0.87 ALDH1A1 (0.41) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL18533427 0.82 NPC1 (0.47) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL13665501 0.81 DPP4 (0.49) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL1712955 0.81 DPP4 (0.49) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL1712954 0.81 DPP4 (0.45) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL16083084 0.79 ALDH1A1 (0.57) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL14311809 0.79 DPP7 (0.51) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL10272430 0.79 DPP4 (0.51) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL13974450 0.79 DPP7 (0.51) DPP4DPP7CHRM2CHRM4CHRM1
SCHEMBL8246597 0.79 DPP7 (0.51) DPP4DPP7CHRM2CHRM4CHRM1

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-1847532-B1 IGF-1R INHIBITOR KYOWA HAKKO KIRIN CO LTD (JP) 2013-06-05 EP disclosed