SCHEMBL10388535

SCHEMBL10388535

O=CN1CCNC(Cc2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA4 P22748 2/20 0.48
CA9 Q16790 2/20 0.48
HDAC1 Q13547 1/20 0.40
PLG P00747 2/20 0.39
LTA4H P09960 1/20 0.39
ADRB1 P08588 2/20 0.38
GBA1 P04062 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL27263975 0.85 PLG (0.41) PLGLTA4H
SCHEMBL23222258 0.82 SLC6A4 (0.45) SLC6A2SLC6A4
SCHEMBL8113311 0.81 SIGMAR1 (0.39)
SCHEMBL19447362 0.78 POLB (0.51) POLBCA1CA2CA4CA9
SCHEMBL21675573 0.78 POLB (0.51) POLBCA1CA2CA4CA9
SCHEMBL14986325 0.78 POLB (0.51) POLBCA1CA2CA4CA9
SCHEMBL11386097 0.78 POLB (0.51) POLBCA1CA2CA4CA9
SCHEMBL1368801 0.78 POLB (0.51) POLBCA1CA2CA4CA9
SCHEMBL4749948 0.77 CA1 (0.62) POLBCA1CA2CA4CA9
SCHEMBL3495230 0.77 CA1 (0.62) POLBCA1CA2CA4CA9

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-4971957-A ANTILIPEMIC AGENTS, ANTICHOLESTEROL AGENTS, BENZENECARBOXAMIDOPHOSPHONATES OR BENZENETHIOCARBOXAMIDOPHOSPHONATES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1990-11-20 US disclosed