SCHEMBL21574027

SCHEMBL21574027

NCCCCCCCCCCCC(O)N1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 9/20 0.35
DPP4 P27487 5/20 0.35
DPP8 Q6V1X1 4/20 0.35
DPP9 Q86TI2 3/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
CPB2 Q96IY4 2/20 0.33
FAP Q12884 1/20 0.33
GSR P00390 1/20 0.33
DNM1 Q05193 1/20 0.33
LMNA P02545 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
SCHEMBL13356069 0.98 DPP7 (0.36) DPP7DPP4DPP8DPP9CPB2
SCHEMBL3249614 0.82 DPP7 (0.36) DPP7DPP4DPP8DPP9FAP
SCHEMBL3926243 0.79 GPR84 (0.41) LMNABLM
SCHEMBL7296759 0.78 MAPT (0.32)
SCHEMBL3924873 0.78 L3MBTL1 (0.40) LMNA
SCHEMBL28284934 0.78 L3MBTL1 (0.40) LMNA
SCHEMBL3928047 0.77 L3MBTL1 (0.39) LMNABLM
SCHEMBL29030623 0.75 DPP7 (0.40) DPP7DPP4DPP8DPP9CA12
SCHEMBL27860887 0.75 DPP7 (0.40) DPP7DPP4DPP8DPP9CA12
SCHEMBL3932212 0.75 L3MBTL1 (0.41) LMNA

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-3569593-A1 PRODUCTION OF AMINES VIA A HYDROAMINOMETHYLATION REACTION Universität Wien (AT) 2019-11-20 EP disclosed