SCHEMBL6064007

SCHEMBL6064007

CCNC(=S)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.55
ALOX12 P18054 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HPGD P15428 2/20 0.55
ALPL P05186 1/20 0.55
ALDH1A1 P00352 2/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
MAPT P10636 2/20 0.47
IDO1 P14902 2/20 0.46
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
KDM4E B2RXH2 1/20 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
SCHEMBL28343162 0.84 SMN1; SMN2 (0.51) GAAALOX12SMN1; SMN2HPGDALPL
SCHEMBL5354786 0.81 ALOX12 (0.65) GAAALOX12SMN1; SMN2HPGDALPL
SCHEMBL14543245 0.80 TAAR1 (0.46) GAAALOX12SMN1; SMN2HPGDALPL
SCHEMBL8325341 0.78 ALDH1A1 (0.45) GAAALOX12SMN1; SMN2HPGDALDH1A1
SCHEMBL21379852 0.78 GAA (0.48) GAAALOX12SMN1; SMN2HPGDALPL
SCHEMBL9629891 0.78 HPGD (0.56) GAAALOX12HPGDALDH1A1MAPT
SCHEMBL9815471 0.77 GAA (0.47) GAAALOX12SMN1; SMN2HPGDALPL
Phenylthioacetylglycine SCHEMBL11381408 0.76 AKR1B1 (0.54) GAASMN1; SMN2HPGDALDH1A1NPC1
SCHEMBL1059890 0.76 KMT2A (0.56) GAAALOX12SMN1; SMN2HPGDALDH1A1
SCHEMBL1095091 0.75 MEN1 (0.61) GAAHPGDALDH1A1NPC1RAB9A

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-1694748-A1 METHOD OF MODIFYING A FLUOROPOLYMERIC SUBSTRATE AND COMPOSITE ARTICLES THEREBY 3M Innovative Properties Company (US) 2006-08-30 EP disclosed
WO-2005047373-A1 METHOD OF MODIFYING A FLUOROPOLYMERIC SUBSTRATE AND COMPOSITE ARTICLES THEREBY 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-05-26 WO disclosed