SCHEMBL22868151

SCHEMBL22868151

CC(C)(Cc1ccccc1)SC(=S)n1cccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
FBP1 P09467 1/20 0.38
CYP2D6 P10635 2/20 0.37
LMNA P02545 2/20 0.37
TRPA1 O75762 1/20 0.37
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
MGLL Q99685 4/20 0.34
CYP3A4 P08684 2/20 0.34
PRMT1 Q99873 1/20 0.34
PHGDH O43175 1/20 0.34
IDO1 P14902 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
ALOX12 P18054 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
SCHEMBL29687151 0.75 FBP1 (0.42) TAAR1FBP1CYP2C19CYP3A4ALDH1A1
SCHEMBL10294612 0.71 MGLL (0.53) SLC6A2TAAR1FBP1CYP2D6LMNA
SCHEMBL307496 0.70 CA12 (0.53) TAAR1FBP1MGLLPHGDHIDO1
SCHEMBL9784951 0.69 SLC6A2 (0.52) SLC6A2TAAR1CYP2D6LMNATRPA1
SCHEMBL779669 0.68 TAAR1 (0.56) SLC6A2TAAR1CYP2D6LMNATRPA1
SCHEMBL776075 0.68 TAAR1 (0.56) SLC6A2TAAR1CYP2D6LMNATRPA1
SCHEMBL6915548 0.67 SLC6A2 (0.50) SLC6A2TAAR1CYP2D6LMNATRPA1
Hydrochloric Acid SCHEMBL28192979 0.67 SLC6A2 (0.50) SLC6A2TAAR1CYP2D6LMNATRPA1
SCHEMBL27346957 0.66 SLC6A2 (0.59) SLC6A2TAAR1CYP2D6LMNATRPA1
SCHEMBL347187 0.65 SLC6A2 (0.64) SLC6A2TAAR1CYP2D6LMNATRPA1

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-11787952-B2 Zwitterionic monomers, polyzwitterionic polymers formed therefrom, surface functionalization and surface modification ABF TECHNOLOGIES, LLC (US) 2023-10-17 US disclosed
US-11787952-B2 Zwitterionic monomers, polyzwitterionic polymers formed therefrom, surface functionalization and surface modification ABF TECHNOLOGIES, LLC (US) 2023-10-17 US disclosed
US-20210002493-A1 ZWITTERIONIC MONOMERS, POLYZWITTERIONIC POLYMERS FORMED THEREFROM, SURFACE FUNCTIONALIZATION AND SURFACE MODIFICATION TRELLEBORG SEALING SOLUTIONS PLYMOUTH, LLC 2021-01-07 US disclosed