SCHEMBL4854668

SCHEMBL4854668

c1cc(CSCC2CS2)cc(CSCC2CSS2)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
SLC11A2 P49281 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
LMNA P02545 1/20 0.30
TNF P01375 1/20 0.30
NOD1 Q9Y239 1/20 0.30
CRBN Q96SW2 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
SCHEMBL1402639 0.92 SLC11A2 (0.36) ACHESLC11A2KDM4ECYP1A2CYP3A4
SCHEMBL4862284 0.81 ACHE (0.33) ACHESLC11A2CYP3A4SMN1; SMN2
SCHEMBL2769392 0.80 QRFPR (0.32) ACHE
SCHEMBL4859681 0.80 CYP1A2 (0.32) CYP1A2CYP2C9CYP2C19
SCHEMBL14209991 0.79 CRBN (0.44) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL13346085 0.77 TP53 (0.35)
SCHEMBL1402882 0.77 CRBN (0.33) CYP1A2CYP2D6CYP2C19HTTSMN1; SMN2
SCHEMBL1093206 0.76 SLC11A2 (0.35) SLC11A2NPC1RAB9ALMNA
SCHEMBL4853977 0.73 CRBN (0.31) CRBN
SCHEMBL6599956 0.73 CRBN (0.30) CRBN

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
US-7354989-B2 Thioepoxy based polymerizable composition and method for production thereof MITSUI CHEMICALS, INC. (JP) 2008-04-08 US disclosed
US-20050124783-A1 Thioepoxy based polymerizable composition and method for production thereof MITSUI CHEMICALS, INC. (JP) 2005-06-09 US disclosed
EP-1484352-A1 THIOEPOXY BASED POLYMERIZABLE COMPOSITION AND METHOD FOR PRODUCTION THEREOF MITSUI CHEMICALS, INC. (JP) 2004-12-08 EP disclosed