SCHEMBL15317

SCHEMBL15317

Cc1c(N=C=O)cc(N=C=O)cc1N=C=O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.61
TRPA1 O75762 1/20 0.61
TDP1 Q9NUW8 2/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.37
CYP1A2 P05177 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30

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
SCHEMBL6057020 0.98 CYP3A4 (0.59) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL163362 0.89 CYP3A4 (0.60) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL1484218 0.86 CYP3A4 (0.52) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL8608054 0.86 CYP3A4 (0.52) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL9643670 0.86 CYP3A4 (0.52) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL14812425 0.86 CYP3A4 (0.52) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL28191046 0.85 CYP3A4 (0.61) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL2246041 0.84 CYP3A4 (0.50) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL11317516 0.84 CYP3A4 (0.54) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL490999 0.84 CYP3A4 (0.46) CYP3A4TRPA1TDP1MAPK1ALDH1A1

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

Appears in 10422 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260128370-A1 SOLID ELECTROLYTE COMPOSITION, SOLID ELECTROLYTE FORMED FROM THE COMPOSITION AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME ELECTROLYTE KOLON INC (KR) 2026-05-07 US claimed
EP-4326795-B1 POLYMERIZATION OF A SILANE-MODIFIED POLYMER, WHICH IS PRODUCED BY MEANS OF A RADICAL CHAIN POLYMERIZATION, IN A POLYOL OR IN A PREPOLYMER WITH TERMINAL ISOCYANATE GROUPS, AND USE THEREOF IN POLYURETHANE FORMULATIONS FOLLMANN GMBH & CO KG (DE) 2026-02-25 EP claimed
WO-2025228982-A1 PROCESS FOR RECYCLING A COMPOSITION COMPRISING A POLY(UREA-URETHANE) POLYMER WITH HINDERED UREA BONDS BASF SE (DE) 2025-11-06 WO claimed
WO-2025228991-A1 RECYCLABLE POLY(UREA-URETHANE) SYSTEM BASF SE (DE) 2025-11-06 WO claimed
EP-4638541-A1 RECYCLABLE POLY(UREA-URETHANE) POLYMER AND COMPOSITE WITH DYNAMIC HINDERED UREA BONDS (HUBS) BASF SE (DE) 2025-10-29 EP claimed
EP-4626944-A1 SUSTAINABLE WOOD ADHESIVE FORMULATION Huntsman International LLC (US) 2025-10-08 EP claimed
EP-4605483-A1 FREE-RADICAL POLYMERISATION OF UV-CROSSLINKING SILANE ACRYLATES IN AN ISOCYANATE-CONTAINING POLYURETHANE MATRIX Follmann GmbH & Co. KG (DE) 2025-08-27 EP claimed
EP-4601064-A1 SOLID ELECTROLYTE COMPOSITION, SOLID ELECTROLYTE FORMED THEREFROM, AND LITHIUM SECONDARY BATTERY COMPRISING SAME Kolon Industries, Inc. (KR) 2025-08-13 EP claimed
WO-2025111156-A1 COATING COMPOSITIONS THAT CURE AT LOW TEMPERATURES PPG INDUSTRIES OHIO, INC. (US) 2025-05-30 WO claimed
CN-120051543-A Free radical polymerization of UV-crosslinked silane acrylates in polyurethane matrices containing isocyanate groups 福漫有限责任两合公司 2025-05-27 CN claimed
US-4618635-A RADIATION CURABLE; HIGH TENSILE STRENGTH UNION CARBIDE CORPORATION (US) 1986-10-21 US claimed
EP-0072915-B1 PROCESS FOR PREPARING 2,4,6-TRIISOCYANATOTOLUENE BASF Aktiengesellschaft (DE) 1986-05-21 EP claimed
US-4560617-A FERROMAGNETIC PARTICLES AND RADIATION POLYMERIZABLE RESIN BINDER TDK CORPORATION (JP) 1985-12-24 US claimed
US-4456493-A ALKYNEDIOL AND FORMALDEHYDE PREPOLYMER WITH POLYISOCYANATE THIOKOL CORPORATION (US) 1984-06-26 US claimed
EP-0072915-A2 Process for preparing 2,4,6-triisocyanatotoluene BASF Aktiengesellschaft (DE) 1983-03-02 EP claimed
US-4369302-A Curable resin composition comprising cyanate ester and polyisocyanate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-01-18 US claimed
US-RE29711-E POLYOXYALKYLENE POLYOL ENDCAPPED WITH POLYISOCYANATES, POLYAMINE; TOUGH, ABRASION RESISTANT W. R. GRACE & CO. (US) 1978-07-25 US claimed
US-4048253-A HEAT TREATMENT FUJI PHOTO FILM CO., LTD. (JA) 1977-09-13 US claimed
US-3950471-A Manufacture of molded articles of particulate foamed ethylene copolymers BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-04-13 US claimed
US-3931117-A Coating powders for protective films based on ε-caprolactam-blocked isocyanates COOK PAINT AND VARNISH COMPANY (US) 1976-01-06 US claimed