SCHEMBL6003330

SCHEMBL6003330

[CH](Oc1ccccc1)n1cccc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.38
TSHR P16473 1/20 0.38
CA4 P22748 1/20 0.35
KCNA3 P22001 1/20 0.32
CA5A P35218 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
NR1H2 P55055 1/20 0.30
BAX Q07812 1/20 0.30
MAOA P21397 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
SCHEMBL6002504 0.76 TBXAS1 (0.44) LTA4HTSHRMAPTKMT2A
SCHEMBL2818333 0.68 LTA4H (0.50) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL2818335 0.68 LTA4H (0.50) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL16782647 0.68 LTA4H (0.50) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL6606014 0.68 LTA4H (0.50) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL536918 0.67 TSHR (0.43) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL10490391 0.66 LTA4H (0.49) LTA4HTSHRKMT2A
SCHEMBL28369275 0.66 LTA4H (0.47) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL196320 0.64
Formic Acid Phenyl Ester SCHEMBL2662 0.64

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed