SCHEMBL8033735

SCHEMBL8033735

C=C(N)Cc1ccc([SnH])cc1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.37
F2 P00734 1/20 0.31
PLG P00747 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
C1S P09871 1/20 0.31
PRSS3 P35030 1/20 0.31
NOS1 P29475 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
SCHEMBL10535299 0.78 CA2 (0.60) CA2
SCHEMBL23891925 0.78 ABAT (0.50) CA2NOS1
SCHEMBL9256936 0.78 ALDH1A1 (0.48) CA2NOS1
SCHEMBL13069072 0.76 LOXL2 (0.48)
SCHEMBL12942979 0.76 IDO1 (0.47)
SCHEMBL24386036 0.76 IDO1 (0.47) CA2
SCHEMBL4958170 0.75 CES1 (0.50) NOS1
SCHEMBL24258273 0.71 NOS1 (0.52) CA2NOS1
SCHEMBL8280913 0.71 ALDH1A1 (0.52) CA2F2PLGPRSS1PRSS2
SCHEMBL17790151 0.71 NOS1 (0.41) CA2F2PLGPRSS1PRSS2

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-6022822-A Organotin compound and catalyst for transesterification comprising the same RYOJI NOYORI (JP) 2000-02-08 US disclosed