SCHEMBL583176

SCHEMBL583176

CC(C)Cl.N=C=O.N=C=O

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42

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
Isobutane SCHEMBL7910872 0.86
Isobutane SCHEMBL11409032 0.86
Isobutane SCHEMBL3986587 0.86
Chloroform SCHEMBL28986876 0.86 LMNA (0.40)
SCHEMBL4638041 0.82 ALDH1A1 (0.46) ALDH1A1TSHR
Chloromethane SCHEMBL17457033 0.80
Isopropyl Alcohol SCHEMBL29031793 0.78 ALDH1A1 (0.50) ALDH1A1
SCHEMBL9687998 0.78
SCHEMBL28809843 0.78
Benzene SCHEMBL28758326 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0010355-B1 PHOTO-HARDENABLE COMPOSITION, METHOD OF BONDING MATERIALS THEREWITH AND LAMINATES OBTAINED DELTAGLASS S.A. (CH) 1983-06-22 EP claimed
US-4355077-A Photocured lamina of unsaturated urethane/monomer adhesive blend with a transparent layer DELTAGLASS S.A. (CH) 1982-10-19 US claimed
US-4297185-A Photosetting adhesive from unsaturated oligomer, photoinitiator, and betaine-forming mixture of unsaturated tert.amine and unsaturated acid TECHINTER S.A. (CH) 1981-10-27 US claimed
EP-0010355-A1 Photo-hardenable composition, method of bonding materials therewith and laminates obtained DELTAGLASS S.A. (CH) 1980-04-30 EP claimed
EP-2091731-B1 PREPREG LAMINATES Henkel IP & Holding GmbH (DE) 2016-11-30 EP disclosed
US-20120329945-A1 BENZOXAZINE-CONTAINING COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2012-12-27 US disclosed
EP-2493958-A1 BENZOXAZINE-CONTAINING COMPOSITIONS Henkel AG & Co. KGaA (DE) 2012-09-05 EP disclosed
EP-2331624-B1 BENZOXAZINE-BASED COMPOSITIONS CONTAINING ISOCYANATE-BASED TOUGHENERS HENKEL AG & CO KGAA (DE) 2012-02-15 EP disclosed
US-8029889-B1 Prepregs, towpregs and preforms HENKEL CORPORATION (US) 2011-10-04 US disclosed
US-20110172356-A1 BENZOXAZINE-BASED COMPOSITIONS CONTAINING ISOCYANATE-BASED TOUGHENERS KREILING STEFAN 2011-07-14 US disclosed
US-7976670-B2 Storage stable, single-package; free of aromatic and tertiary amines, imides and sulfimides such as saccharin; polymerizable acrylic ester and activation system of peroxide free radical catalyst and transition metal metallocene microencapsulated in a initiator and metallocene impermeable polymer APPLETON PAPERS INC. (US) 2011-07-12 US disclosed
EP-2331624-A1 BENZOXAZINE-BASED COMPOSITIONS CONTAINING ISOCYANATE-BASED TOUGHENERS Henkel AG & Co. KGaA (DE) 2011-06-15 EP disclosed
US-4039705-A SHEETS AND TAPES, TWO DIFFERENTIAL RELEASE SURFACES AVERY INTERNATIONAL CORPORATION (US) 1977-08-02 US disclosed
US-RE29118-E POLYOL MIXTURES FORMED BY POLYMERIZING AN ETHYLENICALLY UNSATURATED MONOMER IN A POLYOL Stamberger, Paul (US) 1977-01-18 US disclosed
US-4001180-A METHYLENEBIS(METHYL ANTHRANILATE) AND AN ISOCYANATE-TERMINATED PREPOLYMER DOYLE EARL N 1977-01-04 US disclosed
US-3996143-A Cured acrylate bearing member KAMATICS CORPORATION (US) 1976-12-07 US disclosed
US-3996308-A Anaerobic pressure sensitive adhesive composition AVERY PRODUCTS CORPORATION (US) 1976-12-07 US disclosed
US-3993815-A Anaerobic pressure sensitive adhesive stocks AVERY PRODUCTS CORPORATION (US) 1976-11-23 US disclosed
US-RE28715-E UNSATURATED MONOMERS AND POLYOLS Stamberger, Paul (US) 1976-02-17 US disclosed
US-3931678-A Dental filling method and composition formed thereby LOCTITE (IRELAND) LIMITED (EI) 1976-01-13 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 (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-20120329945-A1 BENZOXAZINE-CONTAINING COMPOSITIONS XDH, TYR, CYP4Z1 ALDH1A1 415/4885TSHR 4166/4885

“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.