SCHEMBL454426

SCHEMBL454426

O=C=NCN=C=O.c1ccc2c(c1)-c1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPK1 P28482 2/20 0.39
S100A4 P26447 2/20 0.39
MAOA P21397 2/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CES2 O00748 1/20 0.39
APAF1 O14727 1/20 0.39
TERT O14746 1/20 0.39
NPC1 O15118 1/20 0.39
PLIN1 O60240 1/20 0.39
TDP2 O95551 1/20 0.39
S1PR4 O95977 1/20 0.39
LMNA P02545 1/20 0.39
PLA2G1B P04054 1/20 0.39
BCHE P06276 1/20 0.39
PTPRC P08575 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL3281681 0.84 MEN1 (0.39) MEN1KMT2AMAPK1S100A4MAOA
Biphenyl SCHEMBL15542 0.82 ALDH1A1 (0.45) MAPK1LMNAMAPTHTTSMN1; SMN2
O-Xylene SCHEMBL27555238 0.80 TSHR (0.48) KMT2AMAPTHTTALDH1A1TSHR
Benzene SCHEMBL19066305 0.80
Benzene SCHEMBL21082728 0.80
Benzene SCHEMBL740866 0.80
Diphenylmethane SCHEMBL8938749 0.78 CALM1 (0.55) MAOALMNAALDH1A1TSHRCYP3A4
Toluene SCHEMBL11027465 0.78 LMNA (0.50) MEN1KMT2APOLBKDM4ECES2
Phenol SCHEMBL7102161 0.78 TDP1 (0.50) MEN1KMT2AMAOACES2NPC1
SCHEMBL21631 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4665791-A1 METHOD FOR RECOVERING RAW MATERIALS FROM POLYESTER-POLYURETHANE-ELASTOMER-CONTAINING POLYMER COMPOSITIONS Covestro Deutschland AG (DE) 2025-12-24 EP claimed
WO-2025228991-A1 RECYCLABLE POLY(UREA-URETHANE) SYSTEM BASF SE (DE) 2025-11-06 WO 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
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-4634151-A1 PROCESS FOR PREPARING AT LEAST ONE POLYISOCYANATE FROM CO2 BASF SE (DE) 2025-10-22 EP claimed
US-12410378-B2 Methods of making pol yurea powders, gels and greases, and related compositions made therefrom Novitas Chem Solutions (US) 2025-09-09 US claimed
US-20250223420-A1 METHOD FOR RECOVERING RAW MATERIALS FROM POLYURETHANE PRODUCTS COVESTRO DEUTSCHLAND AG (DE) 2025-07-10 US claimed
WO-2025098832-A1 POTTING MATERIAL FOR STABILIZATION OF BATTERY CELLS IN A BATTERY MODULE BASF SE (DE) 2025-05-15 WO claimed
EP-4514884-A1 METHOD FOR RECOVERING RAW MATERIALS FROM ISOCYANURATE-CONTAINING POLYURETHANE PRODUCTS Covestro Deutschland AG (DE) 2025-03-05 EP claimed
WO-2025027659-A1 PEPTIDE MIMETIC CONJUGATED 3D POROUS POLYMER SCAFFOLD COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2025-02-06 WO claimed
US-5094914-A Encapsulated by pore-free sheaths E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-03-10 US claimed
EP-0454446-A1 Thermosettable compositions containing alkoxylated aromatic compounds ARCO Chemical Technology, L.P. (US) 1991-10-30 EP claimed
US-5059670-A Composites, reinforced molding materials ARCO CHEMICAL TECHNOLOGY, INC. (US) 1991-10-22 US claimed
US-5048608-A Well completion ATLANTIC RICHFIELD COMPANY (US) 1991-09-17 US claimed
US-5041477-A Oligomeric aromatic dispersing agents, method of making same, and dispersions made therefrom BASF CORPORATION 1991-08-20 US claimed
US-4978779-A Thermal decomposition of corresponding ureas ARCO CHEMICAL TECHNOLOGY, INC. (US) 1990-12-18 US claimed
EP-0402020-A1 An integrated process for the preparation of methylene diphenylene diisocyanates and polymethylene polyphenylene poly (isocyanates) from diamines and polyamines ARCO CHEMICAL TECHNOLOGY, INC. (US) 1990-12-12 EP claimed
US-4920192-A Well completion ATLANTIC RICHFIELD COMPANY (US) 1990-04-24 US claimed
US-4873364-A THERMAL DECOMPOSITION OF THE CORRESPONDING UREA IN THE PRESENCE OF A TERTIARY AMINE HYDROHALIDE ARCO CHEMICAL TECHNOLOGY, INC. (US) 1989-10-10 US claimed
US-4360615-A CHEMICALLY MODIFIED TALL OIL PITCH AMERICAN CYANAMID COMPANY (US) 1982-11-23 US claimed