SCHEMBL1118367

SCHEMBL1118367

C=CCCCCCCCCCS(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
ABCC4 O15439 1/20 0.46
EPHX2 P34913 1/20 0.43
TSHR P16473 2/20 0.42
APP P05067 1/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 3/20 0.41
LPAR3 Q9UBY5 2/20 0.41
LPAR2 Q9HBW0 1/20 0.41
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
SLC6A6 P31641 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35
TRPA1 O75762 2/20 0.34
USP2 O75604 2/20 0.33
CYP3A4 P08684 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RECQL P46063 1/20 0.33
CA2 P00918 1/20 0.32

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
SCHEMBL93616 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL3700017 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL8784927 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL3693008 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL3690296 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL23630404 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL8218999 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL3694314 1.00 MAPT (0.46) MAPTABCC4EPHX2TSHRAPP
SCHEMBL10716331 0.98 MAPT (0.45) MAPTABCC4EPHX2TSHRAPP
Fluoride SCHEMBL27896506 0.98 MAPT (0.45) MAPTABCC4EPHX2TSHRAPP

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108350146-B Epoxy resin composition containing long-chain alkylene group 日产化学工业株式会社 2021-03-16 CN disclosed
EP-2280918-A1 PRODUCTION OF COMPOUNDS COMPRISING CF3O GROUPS Merck Patent GmbH (DE) 2011-02-09 EP disclosed
WO-2009141053-A1 PRODUCTION OF COMPOUNDS COMPRISING CF3O GROUPS MERCK PATENT GMBH, (DE) 2009-11-26 WO disclosed
US-6153322-A Methods for making fluorinated surface modifying agents, methods of using same and products made using same HOUSTON, UNIVERSITY OF 2000-11-28 US disclosed
US-6133274-A TREATING DISEASE MEDIATED BY INTRACELLULAR SIGNALING THROUGH ONE OR TWO SPECIFIC INTRACELLULAR SIGNALING PATHWAYS; A XANTHINYL HAVING AT LEAST ONE NITROGEN SUBSTITUTED BY AN HYDROXYALKYL; ANTITUMOR,-CARCINOGENIC,-ARTHRITIC AGENTS CELL THERAPEUTICS, INC. (US) 2000-10-17 US disclosed
US-6121270-A N-(EPOXYALKYL)XANTHINE DERIVATIVES WHICH MODULATE CELLULAR RESPONSES TO NOXIOUS, PRO-INFLAMMATORY STIMULI CELL THERAPEUTICS, INC. (US) 2000-09-19 US disclosed
US-6100271-A Therapeutic compounds containing xanthinyl CELL THERAPEUTICS, INC. (US) 2000-08-08 US disclosed
US-6043250-A Methods for using therapeutic compounds containing xanthinyl CELL THERAPEUTICS, INC. (US) 2000-03-28 US disclosed
US-6020337-A Electronegative-substituted long chain xanthine compounds CELL THERAPEUTICS, INC. (US) 2000-02-01 US disclosed
US-5866576-A COMPOUNDS THAT ACT AS DRUGS ON THE CELLULAR AND BIOCHEMICAL LEVEL TO MODULATE CELLULAR RESPONSES TO NOXIOUS, PRO-INFLAMMATORY STIMULI. CELL THERAPEUTICS, INC. (US) 1999-02-02 US disclosed
US-5473070-A Cell stimulus response modulators CELL THERAPEUTICS, INC. (US) 1995-12-05 US disclosed
EP-0669825-A1 HYDROXYL-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1995-09-06 EP disclosed
WO-1995022546-A1 INTRACELLULAR SIGNALLING MEDIATORS CELL THERAPEUTICS, INC. (US) 1995-08-24 WO disclosed
US-5440041-A Antagonists to control intracellular levels of specific unsaturated phosphatidic acids CELL THERAPEUTICS, INC. (US) 1995-08-08 US disclosed
EP-0662834-A1 NOVEL EPOXIDE-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1995-07-19 EP disclosed
WO-1994022449-A1 THERAPEUTIC COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-10-13 WO disclosed
US-5354756-A Inhibiting second messenger pathway CELL THERAPEUTICS, INC. (US) 1994-10-11 US disclosed
WO-1994015605-A1 ACETAL OR KETAL SUBSTITUTED THERAPEUTIC COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-07-21 WO disclosed
WO-1994011001-A1 HYDROXYL-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-05-26 WO disclosed
WO-1994006431-A1 NOVEL EPOXIDE-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-03-31 WO disclosed