SCHEMBL6002816

SCHEMBL6002816

CCOCc1sc(-c2ccccc2)nc1C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.51
PPARD Q03181 3/20 0.51
TRPM8 Q7Z2W7 2/20 0.50
ALOX5 P09917 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
CDC7 O00311 1/20 0.46
DBF4 Q9UBU7 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 2/20 0.43
TP53 P04637 2/20 0.43
THRB P10828 2/20 0.43

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
SCHEMBL2097759 0.84 FFAR1 (0.53) FFAR1PPARDTRPM8SMN1; SMN2L3MBTL1
SCHEMBL2097756 0.83 FFAR1 (0.52) FFAR1PPARDTRPM8SMN1; SMN2L3MBTL1
SCHEMBL6840453 0.82 L3MBTL1 (0.55) FFAR1PPARDTRPM8SMN1; SMN2L3MBTL1
SCHEMBL27943053 0.81 LMNA (0.53) FFAR1PPARDTRPM8SMN1; SMN2MAPT
SCHEMBL7693031 0.79 ALOX5 (0.57) FFAR1PPARDALOX5SMN1; SMN2NPC1
Bromobenzene SCHEMBL27953553 0.77 CDC7 (0.46) FFAR1PPARDTRPM8CDC7DBF4
Chlorobenzene SCHEMBL27953551 0.77 CDC7 (0.46) FFAR1PPARDTRPM8CDC7DBF4
Fluorobenzene SCHEMBL27942966 0.77 CDC7 (0.46) FFAR1PPARDCDC7DBF4MAPT
SCHEMBL1569202 0.77 SMN1; SMN2 (0.53) FFAR1PPARDTRPM8SMN1; SMN2L3MBTL1
SCHEMBL2413521 0.77 SMN1; SMN2 (0.51) FFAR1PPARDSMN1; SMN2NPC1HPGD

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