SCHEMBL2929318

SCHEMBL2929318

CC1CC(C)(C)CC(CN=C=O)(N=C=O)C1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32

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
SCHEMBL2329869 1.00 ALDH1A1 (0.46) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL29360260 0.85 ALDH1A1 (0.34) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL10013736 0.79 ALDH1A1 (0.66) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL6672804 0.78 ALDH1A1 (0.31) ALDH1A1CYP3A4
SCHEMBL1081191 0.73 ALDH1A1 (0.34) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL434084 0.73 ALDH1A1 (0.34) ALDH1A1CYP3A4ESR1ESR2
SCHEMBL19260134 0.72 ALDH1A1 (0.38) ALDH1A1CYP3A4
SCHEMBL2221398 0.72 ALDH1A1 (0.49) ALDH1A1CYP3A4
SCHEMBL9189621 0.72
SCHEMBL9293471 0.72 ALDH1A1 (0.49) ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5837796-A CATALYTIC TRIMERIZATION OF POLYISOCYANATES TO FORM POLYISOCYANURATES AS BONDING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1998-11-17 US claimed
EP-0189072-B1 DIISOCYANATES CONTAINING URETHANE GROUPS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS BINDER OR AS BINDER COMPONENT OF POLYURETHANE-LACQUERS BAYER AG (DE) 1991-08-14 EP claimed
EP-4635928-A1 SCHEAR VISCOSITY OF THE MULTI-COMPONENT RESIN SYSTEM BASED ON ISOCYANATE AMINE ADDUCTS Hilti Aktiengesellschaft (LI) 2025-10-22 EP disclosed
EP-4635927-A1 SILANE-FUNCTIONAL POLYISOCYANATES FOR MULTI-COMPONENT CHEMICAL FASTENING SYSTEMS BASED ON ISOCYANATE-AMINE ADDUCTS Hilti Aktiengesellschaft (LI) 2025-10-22 EP disclosed
WO-2025124914-A1 MULTI-COMPONENT RESIN SYSTEM SUITABLE FOR CHEMICAL DOWELS HAVING A HIGH FILLING DEGREE HILTI AKTIENGESELLSCHAFT (LI) 2025-06-19 WO disclosed
EP-4570772-A1 MULTI-COMPONENT RESIN SYSTEM SUITABLE FOR CHEMICAL DOWELS HAVING A HIGH FILLING DEGREE Hilti Aktiengesellschaft (LI) 2025-06-18 EP disclosed
WO-2025108732-A1 POWDERED RECYCLED MATERIALS AS FILLERS FOR MULTI-COMPONENT CHEMICAL FASTENING SYSTEMS BASED ON ISOCYANATE-AMINE ADDUCTS HILTI AKTIENGESELLSCHAFT (LI) 2025-05-30 WO disclosed
WO-2025108733-A1 FUNCTIONAL FILLERS FOR MULTI-COMPONENT CHEMICAL FASTENING SYSTEMS BASED ON ISOCYANATE-AMINE ADDUCTS HILTI AKTIENGESELLSCHAFT (LI) 2025-05-30 WO disclosed
WO-2025108731-A1 SUPERABSORBERS FOR MULTI-COMPONENT CHEMICAL FASTENING SYSTEMS BASED ON ISOCYANATE-AMINE ADDUCTS HILTI AKTIENGESELLSCHAFT (LI) 2025-05-30 WO disclosed
EP-4559945-A1 SUPERABSORBERS FOR MULTI-COMPONENT CHEMICAL FASTENING SYSTEMS BASED ON ISOCYANATE-AMINE ADDUCTS Hilti Aktiengesellschaft (LI) 2025-05-28 EP disclosed
EP-4559883-A1 POWDERED RECYCLED MATERIALS AS FILLERS FOR MULTI-COMPONENT CHEMICAL FASTENING SYSTEMS BASED ON ISOCYANATE-AMINE ADDUCTS Hilti Aktiengesellschaft (LI) 2025-05-28 EP disclosed
US-4268548-A AZOMETHINE, SILANE, ADHESION SCHERING AKTIENGESELLSCHAFT (DE) 1981-05-19 US disclosed
US-4254168-A NONDISCOLORING USED TO MATCH NITROCELLULOSE LACQUERS OR ACRYLIC LACQUERS OR ENAMEL MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1981-03-03 US disclosed
US-4240942-A Process for the preparation of aqueous dispersions or solutions of isocyanate polyaddition products BAYER AKTIENGESELLSCHAFT (DE) 1980-12-23 US disclosed
EP-0018099-A2 Pigment dispersants, pigment concentrates, and their use in aqueous coating compositions and printing inks IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-10-29 EP disclosed
EP-0000568-B1 PROCESS FOR THE PREPARATION OF AQUEOUS DISPERSIONS OR SOLUTIONS OF ISOCYANATE POLYADDITION PRODUCTS; USE OF THESE DISPERSIONS OR SOLUTIONS IN THE PREPARATION OF COATINGS AND FILMS BAYER AG (DE) 1980-08-20 EP disclosed
EP-0004069-A1 Process for the preparation of aqueous solutions or dispersions of polyurethanes and their use for the preparation of coatings or lacquers BAYER AG (DE) 1979-09-19 EP disclosed
US-4151317-A Polyvinyl chloride plastisols and method of coating metal therewith SCHERING AKTIENGESELLSCHAFT (DE) 1979-04-24 US disclosed
EP-0000568-A1 Process for the preparation of aqueous dispersions or solutions of isocyanate polyaddition products; use of these dispersions or solutions in the preparation of coatings and films BAYER AG (DE) 1979-02-07 EP disclosed
EP-0000029-A1 Process for the preparation of aqueous dispersions or solutions of polyurethanes, their use as coatings forf lexible substrates BAYER AG (DE) 1978-12-20 EP disclosed