SCHEMBL8907488

SCHEMBL8907488

CCOC(=O)c1c(O)csc1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
MAPK1 P28482 2/20 0.61
POLB P06746 1/20 0.61
PRKCZ Q05513 7/20 0.60
HSD17B10 Q99714 5/20 0.58
HPGD P15428 3/20 0.58
MAPT P10636 6/20 0.58
GAA P10253 3/20 0.58
KMT2A Q03164 5/20 0.57
MEN1 O00255 4/20 0.57
ALOX15 P16050 3/20 0.57
MPI P34949 1/20 0.57
USP2 O75604 1/20 0.57
KEAP1 Q14145 1/20 0.57
TDP1 Q9NUW8 2/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
PRKCI P41743 1/20 0.55
CA12 O43570 1/20 0.53

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
SCHEMBL162443 0.84 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL4102678 0.83 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL10532585 0.83 ALDH1A1 (0.75) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL10714962 0.82 CA12 (0.56) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL7613063 0.81 PRKCZ (0.63) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
Chloromethane SCHEMBL21192469 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL16643764 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL27969855 0.80 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL25522293 0.80 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ
SCHEMBL8907155 0.80 PRKCZ (0.60) ALDH1A1SMN1; SMN2MAPK1POLBPRKCZ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1175258-A Thienoxazinone derivatives useful as antiviral agents SMITHKLINE BEECHAM PLC (GB) 1998-03-04 CN disclosed
EP-0799230-A1 THIENOXAZINONE DERIVATIVES USEFUL AS ANTIVIRAL AGENTS SMITHKLINE BEECHAM PLC (GB) 1997-10-08 EP disclosed
WO-1996019482-A1 THIENOXAZINONE DERIVATIVES USEFUL AS ANTIVIRAL AGENTS SMITHKLINE BEECHAM PLC (GB) 1996-06-27 WO disclosed