SCHEMBL5573150

SCHEMBL5573150

CCOCCN1CCCC1=O.COCCN1CCC(S)C1=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
ACACB O00763 1/20 0.36
MMP1 P03956 4/20 0.35
MMP3 P08254 4/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PKM P14618 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL29859999 0.84 CYP2D6 (0.37) NPC1RAB9APKM
SCHEMBL31007027 0.82 RECQL (0.36) MMP1MMP3PKM
SCHEMBL1093304 0.82 MMP1 (0.37) MMP1MMP3NPC1RAB9A
SCHEMBL6633070 0.80 PIK3CD (0.47) SMN1; SMN2ACACBMEN1KMT2APKM
SCHEMBL1092477 0.79 MMP1 (0.40) MMP1MMP3
SCHEMBL823276 0.77 PIK3CD (0.50) MEN1KMT2APKMPOLB
SCHEMBL29306449 0.76 KMT2A (0.42) SMN1; SMN2ACACBMEN1KMT2ARAB9A
SCHEMBL28319486 0.74 KMT2A (0.44) MEN1KMT2APKMPOLB
SCHEMBL20096147 0.73 KMT2A (0.43) SMN1; SMN2ACACBMEN1KMT2ARAB9A
SCHEMBL29740518 0.73 SMN1; SMN2 (0.45) SMN1; SMN2MEN1KMT2ARAB9APOLB

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-1827370-A1 HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR Showa Denko K.K. (JP) 2007-09-05 EP disclosed
WO-2006068276-A1 HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR SHOWA DENKO K.K. (JP) 2006-06-29 WO disclosed