SCHEMBL189727

SCHEMBL189727

N=C=O.N=C=O.c1ccc(C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.50
SLC6A4 P31645 3/20 0.50
SLC6A3 Q01959 3/20 0.50
CFTR P13569 1/20 0.44
GOPC Q9HD26 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
CYP2D6 P10635 1/20 0.40
SRC P12931 1/20 0.40
DPP4 P27487 2/20 0.39
TSHR P16473 2/20 0.39
F2 P00734 1/20 0.39
LMNA P02545 2/20 0.39
MAPK1 P28482 1/20 0.39
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
TRPA1 O75762 1/20 0.37

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
SCHEMBL420409 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CFTRGOPC
SCHEMBL11680566 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CFTRGOPC
SCHEMBL28190929 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CFTRGOPC
SCHEMBL28579 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CFTRGOPC
Benzene SCHEMBL28876392 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CFTRGOPC
Methane SCHEMBL28287934 0.97 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3CFTRGOPC
Methane SCHEMBL28162980 0.97 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3CFTRGOPC
Naphthalene SCHEMBL16568502 0.93 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3CFTRGOPC
O-Xylene SCHEMBL27885473 0.89 TSHR (0.43) SLC6A2SLC6A4SLC6A3CFTRGOPC
Chlorobenzene SCHEMBL27846220 0.89 TSHR (0.48) SLC6A2SLC6A4SLC6A3CFTRGOPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121628286-B Phenolic resin foaming material for coal mine filling sealing, preparation method and application 中北大学 2026-05-15 CN claimed
CN-119978778-A Non-toxic anionic waterborne polyurethane and preparation method thereof 万甯(中山)高分子材料科技有限公司 2025-05-13 CN claimed
CN-116768847-B Thiol composition and application thereof in optical material 益丰新材料股份有限公司 2025-04-29 CN claimed
CN-118063723-A Polythiol composition, preparation method and application thereof, and optical material 益丰新材料股份有限公司 2024-05-24 CN claimed
CN-117402490-A Polyamide material and preparation method thereof 上海凯赛生物技术股份有限公司 2024-01-16 CN claimed
CN-117402488-A Polyamide foam material and preparation method and application thereof 上海凯赛生物技术股份有限公司 2024-01-16 CN claimed
CN-117326997-A Polythiol compound, composition for optical material, and preparation method and application thereof 益丰新材料股份有限公司 2024-01-02 CN claimed
CN-117304082-A Polythiol compound for optical resin lens, optical resin lens and preparation method of optical resin lens 益丰新材料股份有限公司 2023-12-29 CN claimed
CN-117186057-A Polythiol composition and application thereof 益丰新材料股份有限公司 2023-12-08 CN claimed
CN-116768847-A Thiol composition and application thereof in optical material 益丰新材料股份有限公司 2023-09-19 CN claimed
WO-2007118880-A1 ORGANOSILICON-POLYUREA BASE POLYMER, ELASTOMER PREPARED THEREFROM, PREPARATION THEREOF AND USE OF THE SAME HENKEL AG & CO. KGAA (DE) 2007-10-25 WO claimed
US-20070032594-A1 Self-crosslinking polyurethane dispersions containing uretdione and isocyanate-reactive groups BAYER MATERIALSCIENCE AG 2007-02-08 US claimed
US-6866965-B2 Polymeric electrolyte and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2005-03-15 US claimed
US-20020042001-A1 Polymeric electrolyte and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2002-04-11 US claimed
WO-1995022576-A1 ADHESION SYSTEM BEAVER MANUFACTURING COMPANY, INC. (US) 1995-08-24 WO claimed
US-5207954-A Method of making coreactable powdered coatings UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-04 US claimed
EP-0420097-A2 Coreactable powdered compositions UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1991-04-03 EP claimed
EP-0111259-B1 PROCESS FOR THE PREPARATION OF COMPOUNDS CONTAINING (METH)ACRYLIC-ACID ESTERS, (METH)ACRYLIC-ACID ESTERS AND ANAEROBICALLY CURABLE ADHESIVES AND PUTTY-LIKE MASSES Henkel Kommanditgesellschaft auf Aktien (DE) 1988-05-25 EP claimed
US-4465718-A A DI- OR TRI-ISOCYANATE WITH GLYCIDOL AND (METH)ACRYLIC ACID HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1984-08-14 US claimed
US-4065362-A Purification of organic isocyanates SUMITOMO BAYER URETHANE CO., LTD. (JA) 1977-12-27 US claimed