SCHEMBL6658830

SCHEMBL6658830

c1ccc(S[S+](c2ccc([S+](c3ccccc3)c3ccccc3)cc2)c2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL31290715 0.91 MAPT (0.43) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL31412242 0.82 MAPT (0.36) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL29535360 0.77 ALDH1A1 (0.41) MAPTHPGDMGLLHSD17B10ALDH1A1
SCHEMBL759390 0.77 ALDH1A1 (0.38) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL12762137 0.77 ALDH1A1 (0.38) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL31591283 0.76 HPGD (0.48) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL92105 0.76 HPGD (0.48) MAPTHPGDSMN1; SMN2MGLLHSD17B10
Hydrochloric Acid SCHEMBL7612105 0.74 HPGD (0.47) MAPTHPGDSMN1; SMN2MGLLHSD17B10
Bromide SCHEMBL4678003 0.74 HPGD (0.47) MAPTHPGDSMN1; SMN2MGLLHSD17B10
Iodide SCHEMBL7997284 0.74 HPGD (0.47) MAPTHPGDSMN1; SMN2MGLLHSD17B10

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
EP-1438347-A1 DEODORIZING AGENT FOR SULFUR- OR NITROGEN-CONTAINING INITIATORS UCB, S.A. (BE) 2004-07-21 EP disclosed
US-20030108810-A1 Deodorizing agent for sulfur- or nitrogen-containing salt photoinitiators UCB, S.A. (BE) 2003-06-12 US disclosed
WO-2003018663-A1 DEODORIZING AGENT FOR SULFUR- OR NITROGEN-CONTAINING INITIATORS UCB, S.A. (BE) 2003-03-06 WO disclosed