SCHEMBL1367446

SCHEMBL1367446

COc1ccccc1-c1ccccc1I

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA12 O43570 1/20 0.52
CA4 P22748 1/20 0.52
CA14 Q9ULX7 1/20 0.52
APP P05067 1/20 0.52
ALDH1A1 P00352 6/20 0.48
HPGD P15428 2/20 0.47
MAPT P10636 2/20 0.47
HTR7 P34969 4/20 0.47
PTGS2 P35354 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
KCNN4 O15554 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
METAP2 P50579 1/20 0.43
ADRA2B P18089 1/20 0.43

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
SCHEMBL29788337 0.85 CA1 (0.71) CA1CA2CA7CA9CA12
SCHEMBL301996 0.85 CA1 (0.71) CA1CA2CA7CA9CA12
SCHEMBL29429633 0.85 CA1 (0.71) CA1CA2CA7CA9CA12
SCHEMBL258451 0.85 CA1 (0.46) CA1CA2CA7CA9CA12
SCHEMBL28899565 0.84 APP (0.50) CA1CA2CA7CA9CA12
SCHEMBL17056215 0.84 KDM4E (0.46) CA1CA2CA7CA9CA12
SCHEMBL28899578 0.84 ALDH1A1 (0.50) CA1CA2CA7CA9CA12
Trifluoroacetic Acid SCHEMBL3518890 0.83 HDAC6 (0.49) CA1CA2CA7CA9CA12
SCHEMBL30599266 0.83 CA1 (0.67) CA1CA2CA7CA9CA12
SCHEMBL3643541 0.83 CA1 (0.67) CA1CA2CA7CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310897-B1 Microencapsulation method, microelectronic devices made therefrom, and heat curable compositions GEN ELECTRIC (US) 1994-08-24 EP claimed
WO-2023053877-A1 PHOTOACID GENERATOR, RESIST COMPOSITION, AND METHOD FOR PRODUCING DEVICE USING SAID RESIST COMPOSITION 東洋合成工業株式会社 2023-04-06 WO disclosed
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN disclosed
CN-115385955-A Tetrabiarylphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN disclosed
CN-110240616-B Tribiaryl monophosphine ligands, methods for their preparation and use in catalytic coupling reactions 东莞市均成高新材料有限公司 2021-03-23 CN disclosed
EP-2163234-B1 DENTAL FILLING/RESTORATION KIT TOKUYAMA DENTAL CORP (JP) 2018-09-26 EP disclosed
US-8546459-B2 Dental filling/restoration kit TOKUYAMA DENTAL CORPORATION (JP) 2013-10-01 US disclosed
US-8506298-B2 Dental filling/restoration kit TOKUYAMA DENTAL CORPORATION (JP) 2013-08-13 US disclosed
US-20110288195-A1 DENTAL FILLING/RESTORATION KIT TOKUYAMA DENTAL CORPORATION (JP) 2011-11-24 US disclosed
EP-1249221-B1 DENTAL ADHESIVE COMPOSITION TOKUYAMA DENTAL CORP (JP) 2010-10-13 EP disclosed
US-20100216096-A1 DENTAL FILLING/RESTORATION KIT TOKUYAMA DENTAL CORPORATION (JP) 2010-08-26 US disclosed
EP-2163234-A1 DENTAL FILLING/RESTORATION KIT Tokuyama Dental Corporation (JP) 2010-03-17 EP disclosed
US-6759449-B2 NONCROSSLINKING POLYMETHYL METHACRYLATE AND POLYETHYL METH-ACRYLATE SPHERICAL FILLER, UNSATURATED ACID FUNCTIONALIZED MONOMER AND POLYMERIZATION INITIATOR TOKUYAMA DENTAL CORPORATION (JP) 2004-07-06 US disclosed
US-20030050359-A1 Dental adhesive composition TOKUYAMA DENTAL CORPORATION (JP) 2003-03-13 US disclosed
EP-0896043-B1 Adhesive TOKUYAMA CORP (JP) 2002-10-23 EP disclosed
EP-1249221-A1 DENTAL ADHESIVE COMPOSITION Tokuyama Dental Corporation (JP) 2002-10-16 EP disclosed
US-6133338-A TYPIFIED BY 6-METHACRYLOYLOXYHEXYL 2-THIOURACIL-5-CARBOXYLATE, A RADICAL-POLYMERIZABLE MONOMER, AND A POLYMERIZATION INITIATOR; DENTAL ADHESIVE; GOOD ADHESIVENESS TO NOBLE METALS AND ALLOYS THEREOF TOKUYAMA CORPORATION (JP) 2000-10-17 US disclosed
EP-0896043-A1 Adhesive TOKUYAMA CORPORATION (JP) 1999-02-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030050359-A1 Dental adhesive composition CAD, ASIC1, CD44 CA1 1006/4885CA2 1769/4885CA7 1255/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.