SCHEMBL8915867

SCHEMBL8915867

O=S(=O)(C=C(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 1.00
CYP1A2 P05177 1/20 1.00
CYP2C9 P11712 1/20 1.00
CYP2C19 P33261 1/20 1.00
NPSR1 Q6W5P4 1/20 1.00
MCOLN3 Q8TDD5 1/20 1.00
L3MBTL1 Q9Y468 1/20 1.00
TLR9 Q9NR96 1/20 0.50
PTGS2 P35354 4/20 0.46
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTR6 P50406 1/20 0.42
HSD11B1 P28845 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
KAT6A Q92794 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40

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
SCHEMBL11738558 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL12449526 0.79 CYP2C19 (0.66) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL11738550 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL29265117 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL4806948 0.78 ALDH1A1 (0.63) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL27518924 0.77 ALDH1A1 (0.63) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL6461532 0.76 ALDH1A1 (0.61) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL11537577 0.76 ALDH1A1 (0.61) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL7372442 0.76 ALDH1A1 (0.61) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL17132068 0.76 ALDH1A1 (0.61) ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-7306894-B2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJIFILM CORPORATION (JP) 2007-12-11 US disclosed
US-7306894-B2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJIFILM CORPORATION (JP) 2007-12-11 US disclosed
US-5637719-A PROTECTING PRIMARY OR SECONDARY AMINE RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1997-06-10 US disclosed
US-5510491-A 2-PROPENYL CHLOROFORMATE AND DERIVATIVES AS BLOCKING AGENTS FOR AMINO GROUPS OF PEPTIDES DURING PEPTIDE SYNTHESIS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1996-04-23 US disclosed
EP-0401817-B1 Reagents for rapid peptide synthesis RES CORP TECHNOLOGIES INC (US) 1995-09-13 EP disclosed
EP-0496836-B1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RES CORP TECHNOLOGIES INC (US) 1995-06-14 EP disclosed
US-5221754-A Easily removable blocking groups to protect primary or secondary amines RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-06-22 US disclosed
WO-1991005564-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1991-05-02 WO disclosed
EP-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP disclosed