SCHEMBL916588

SCHEMBL916588

Cc1ccc(N(O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
TSHR P16473 2/20 0.55
ACHE P22303 4/20 0.50
TDP1 Q9NUW8 1/20 0.50
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
CYP2C19 P33261 1/20 0.39
CA2 P00918 2/20 0.39
LMNA P02545 2/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
ORAI1 Q96D31 1/20 0.39
ORAI2 Q96SN7 1/20 0.39
ORAI3 Q9BRQ5 1/20 0.39
TRPV6 Q9H1D0 1/20 0.39
CA1 P00915 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL13778727 0.85 TEAD4 (0.52) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL12315016 0.83 ALDH1A1 (0.38) ALDH1A1TSHRMAPT
SCHEMBL2138626 0.81 ALDH1A1 (0.55) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL18595403 0.79 ALDH1A1 (0.60) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL812498 0.78 ALDH1A1 (0.67) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL517128 0.78 ALDH1A1 (0.67) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL22083898 0.78 ALDH1A1 (0.67) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL15854781 0.78 ALDH1A1 (0.67) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL30982133 0.77 ALDH1A1 (0.50) ALDH1A1TSHRACHETDP1RAB9A
SCHEMBL11835341 0.77 ALDH1A1 (0.50) ALDH1A1TSHRACHETDP1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116179084-A High-adhesion pavement marking paint and preparation process thereof 浙江兄弟路标涂料有限公司 2023-05-30 CN claimed
US-5401783-A Adhesion-promoting agents incorporating polyvalent cations AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1995-03-28 US claimed
US-5270351-A Adhesion-promoting agents incorporating polyvalent cations AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1993-12-14 US claimed
EP-0081972-B1 TWO-PART, TWO-TIER CURE ADHESIVE COMPOSITION LOCTITE CORPORATION (US) 1986-06-25 EP claimed
CN-116179084-A High-adhesion pavement marking paint and preparation process thereof 浙江兄弟路标涂料有限公司 2023-05-30 CN disclosed
EP-3019141-B1 HARDENABLE DENTAL COMPOSITION CONTAINING A MIXTURE OF AGGLOMERATED AND AGGREGATED NANOPARTICLES, KIT OF PARTS AND USE THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2022-08-31 EP disclosed
US-20180072691-A1 METHODS OF PRODUCING AN HIV MATURATION INHIBITOR BRISTOL-MYERS SQUIBB COMPANY 2018-03-15 US disclosed
US-9782329-B2 Hardenable dental composition containing a mixture of agglomerated and aggregated nano-particles, kit of parts and use thereof SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2017-10-10 US disclosed
US-20160136059-A1 HARDENABLE DENTAL COMPOSITION CONTAINING A MIXTURE OF AGGLOMERATED AND AGGREGATED NANO-PARTICLES, KIT OF PARTS AND USE THEREOF SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2016-05-19 US disclosed
EP-3019141-A1 HARDENABLE DENTAL COMPOSITION CONTAINING A MIXTURE OF AGGLOMERATED AND AGGREGATED NANO-PARTICLES, KIT OF PARTS AND USE THEREOF 3M Innovative Properties Company (US) 2016-05-18 EP disclosed
US-9339443-B2 Dental restorative material based on an antimicrobially active compound IVOCLAR VIVADENT AG (LI) 2016-05-17 US disclosed
WO-2015173321-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING A PARTICULAR IMIDAZOLE COUPLER AND AN OXIDATION BASE L'OREAL (FR) 2015-11-19 WO disclosed
WO-1999062460-A1 PHOTOPOLYMERIZABLE DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-12-09 WO disclosed
US-5789610-A Adhesion-promoting agents incorporating polyvalent cations AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1998-08-04 US disclosed
US-5554665-A PHOTO OR THERMAL ACRYLIC POLYMERIZATION DENTSPLY RESEARCH & DEVELOPMENT CORP. (US) 1996-09-10 US disclosed
US-5444104-A Dental restorative material based on a polycarbonate dimethacrylate JENERIC/PENTRON, INC. (US) 1995-08-22 US disclosed
US-5401783-A Adhesion-promoting agents incorporating polyvalent cations AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1995-03-28 US disclosed
EP-0630641-A1 Method and dispenser for making dental products DENTSPLY INTERNATIONAL, INC. (US) 1994-12-28 EP disclosed
US-5320886-A Hydrophilic crosslinking monomers and polymers made therefrom AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1994-06-14 US disclosed
US-5276068-A Dimethacrylate compounds containing carbonate groups, adhesives, restoration material JENERIC/PENTRON, INC. (US) 1994-01-04 US 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 (2 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-20160136059-A1 HARDENABLE DENTAL COMPOSITION CONTAINING A MIXTURE OF AGGLOMERATED AND AGGREGATED NANO-PARTICLES, KIT OF PARTS AND USE THEREOF NOX3, ILK, NOX1 ALDH1A1 368/4885TSHR 3641/4885ACHE 1057/4885
US-20180072691-A1 METHODS OF PRODUCING AN HIV MATURATION INHIBITOR TMBIM6, MCL1, FURIN ALDH1A1 3180/4885TSHR 4829/4885ACHE 4647/4885

“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.