SCHEMBL14446283

SCHEMBL14446283

CNc1ccc(C=NS(=O)(=O)c2ccccc2C(=O)OC)o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA5A P35218 1/20 0.47
CA9 Q16790 1/20 0.47
KDM4E B2RXH2 5/20 0.43
ATM Q13315 3/20 0.43
POLB P06746 2/20 0.43
ALDH1A1 P00352 3/20 0.41
F2 P00734 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
SLC40A1 Q9NP59 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
BRD4 O60885 1/20 0.37
LMNA P02545 2/20 0.37

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
SCHEMBL14468285 0.81 KDM4E (0.37) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL12444229 0.78 CA1 (0.51) CA1CA2CA5ACA9KDM4E
SCHEMBL10047334 0.77 CA1 (0.50) CA1CA2CA5ACA9KDM4E
SCHEMBL10047327 0.77 ALDH1A1 (0.51) CA1CA2CA5ACA9POLB
SCHEMBL28820232 0.73 CA1 (0.55) CA1CA2CA5ACA9KDM4E
SCHEMBL24175868 0.71 IDO1 (0.55) CA1CA2CA5ACA9KDM4E
SCHEMBL26973697 0.71 CA1 (0.47) CA1CA2CA5ACA9KDM4E
SCHEMBL24175861 0.71 KDM4E (0.55) CA1CA2CA5ACA9KDM4E
SCHEMBL10047342 0.68 ALDH1A1 (0.47) CA1CA2CA5ACA9KDM4E
SCHEMBL16118336 0.68 ALDH1A1 (0.57) CA1CA2KDM4EATMPOLB

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-7244486-B2 Optical recording medium and optical recording method MITSUBISHI CHEMICAL CORPORATION (JP) 2007-07-17 US disclosed