SCHEMBL3146022

SCHEMBL3146022

Cc1ccc(N)cc1.Cc1ccc(S(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.56
TEAD4 Q15561 1/20 0.45
ALDH1A1 P00352 7/20 0.43
MAPT P10636 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 3/20 0.42
CYP2C9 P11712 1/20 0.42
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 2/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAOA P21397 1/20 0.34
CASP1 P29466 2/20 0.34
HSD17B10 Q99714 2/20 0.34
NPC1 O15118 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL3157755 0.90 ACHE (0.50) ACHETEAD4ALDH1A1MAPTTDP1
SCHEMBL50106 0.89 ALDH1A1 (0.50) ACHEALDH1A1MAPTTDP1CYP3A4
SCHEMBL2798687 0.89 ALDH1A1 (0.50) ACHEALDH1A1MAPTTDP1CYP3A4
SCHEMBL3221994 0.89 ALDH1A1 (0.50) ACHEALDH1A1MAPTTDP1CYP3A4
SCHEMBL5312986 0.89 MAPT (0.44) ACHEALDH1A1MAPTTDP1POLB
Water SCHEMBL20269756 0.86 ALDH1A1 (0.48) ACHEALDH1A1MAPTTDP1CYP3A4
SCHEMBL1024087 0.86 ALDH1A1 (0.48) ACHEALDH1A1MAPTTDP1CYP3A4
Water SCHEMBL4901432 0.86 ALDH1A1 (0.48) ACHEALDH1A1MAPTTDP1CYP3A4
SCHEMBL1022295 0.86 ALDH1A1 (0.48) ACHEALDH1A1MAPTTDP1CYP3A4
SCHEMBL10840131 0.86 ALDH1A1 (0.48) ACHEALDH1A1MAPTTDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844847-B2 Sulfur-containing polymerizable monomer and use thereof SUN MEDICAL CO., LTD. (JP) 2023-12-19 US disclosed
WO-2022209944-A1 DENTAL POLYMERIZATION KIT サンメディカル株式会社 2022-10-06 WO disclosed
US-20210298997-A1 SULFUR-CONTAINING POLYMERIZABLE MONOMER AND USE THEREOF SUN MEDICAL CO., LTD. (JP) 2021-09-30 US disclosed
US-11110038-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits MITSUI CHEMICALS, INC. (JP) 2021-09-07 US disclosed
EP-3835289-A1 SULFUR-CONTAINING POLYMERIZABLE MONOMER AND USE THEREOF Sun Medical Co., Ltd. (JP) 2021-06-16 EP disclosed
CN-112513016-A Sulfur-containing polymerizable monomer and use thereof 尚美德齿科材料有限公司 2021-03-16 CN disclosed
US-10709522-B2 Reactive micro applicator with metal-containing additives for use in dental adhesives KULZER GMBH (DE) 2020-07-14 US disclosed
US-20200030194-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS MITSUI CHEMICALS, INC. (JP) 2020-01-30 US disclosed
US-10470980-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits MITSUI CHEMICALS, INC. (JP) 2019-11-12 US disclosed
EP-3148371-B1 REACTIVE MICRO APPLICATOR WITH METAL-CONTAINING ADDITIVES FOR USE IN DENTAL ADHESIVES KULZER & CO GMBH (DE) 2019-09-04 EP disclosed
US-8297975-B2 Reaction-curable adhesive composition and dental adhesive kit SUN MEDICAL CO., LTD. (JP) 2012-10-30 US disclosed
US-20100292359-A1 Reaction-Curable Adhesive Composition and Dental Adhesive Kit SUN MEDICAL CO., LTD. (JP) 2010-11-18 US disclosed
EP-1249221-B1 DENTAL ADHESIVE COMPOSITION TOKUYAMA DENTAL CORP (JP) 2010-10-13 EP disclosed
EP-2156817-A1 REACTION-SETTING ADHESIVE COMPOSITION, AND ADHESIVE MATERIAL KIT FOR DENTAL APPLICATIONS SUN MEDICAL CO., LTD. (JP) 2010-02-24 EP disclosed
EP-0923924-B1 Dental adhesive kit SUN MEDICAL CO LTD (JP) 2005-03-09 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-1249221-A1 DENTAL ADHESIVE COMPOSITION Tokuyama Dental Corporation (JP) 2002-10-16 EP disclosed
US-6288138-B1 Dental adhesive kit SUN MEDICAL CO., LTD. (JP) 2001-09-11 US disclosed
EP-0923924-A2 Dental adhesive kit SUN MEDICAL CO., LTD. (JP) 1999-06-23 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 (6 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-20200030194-A1 DENTAL POLYMERIZABLE MONOMERS, COMPOSITIONS, ADHESIVE DENTAL MATERIALS AND KITS ACTN1, SMCHD1, CAPZA1 ACHE 2879/4885TEAD4 4630/4885ALDH1A1 302/4885
US-10470980-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits HRH3, HRH1, HRH2 ACHE 2751/4885TEAD4 4136/4885ALDH1A1 394/4885
US-20210298997-A1 SULFUR-CONTAINING POLYMERIZABLE MONOMER AND USE THEREOF MGMT, SETDB1, ASH2L ACHE 4198/4885TEAD4 4129/4885ALDH1A1 2202/4885
US-11844847-B2 Sulfur-containing polymerizable monomer and use thereof MGMT, SETDB1, ASH2L ACHE 4198/4885TEAD4 4129/4885ALDH1A1 2202/4885
US-20030050359-A1 Dental adhesive composition CAD, ASIC1, CD44 ACHE 4013/4885TEAD4 3478/4885ALDH1A1 114/4885
US-11110038-B2 Dental polymerizable monomers, compositions, adhesive dental materials and kits ACTN1, SMCHD1, CAPZA1 ACHE 2879/4885TEAD4 4630/4885ALDH1A1 302/4885

“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.