SCHEMBL4640624

SCHEMBL4640624

O=C=NC(CC(N=C=O)c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.46
CYP2C19 P33261 1/20 0.39
NOS3 P29474 1/20 0.35
NOS2 P35228 1/20 0.35
HTR2A P28223 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
CYP2D6 P10635 1/20 0.33
SRC P12931 1/20 0.33
LMNA P02545 2/20 0.32
HRH1 P35367 1/20 0.32
MTOR P42345 1/20 0.32
RAB9A P51151 1/20 0.32
GRM7 Q14831 1/20 0.32
MAPK1 P28482 1/20 0.32
DPP4 P27487 2/20 0.32
F2 P00734 1/20 0.32
TSHR P16473 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
SCHEMBL5892152 0.87 MIF (0.43) MIFCYP2C19NOS3NOS2HTR2A
SCHEMBL9467887 0.84 MIF (0.49) MIFCYP2C19NOS3NOS2TAAR1
SCHEMBL727626 0.83 MIF (0.67) MIFCYP2C19NOS3NOS2LMNA
SCHEMBL9438265 0.83 MIF (0.43) MIFCYP2C19NOS3NOS2HTR2A
SCHEMBL3585197 0.83 MIF (0.43) MIFCYP2C19NOS3NOS2HTR2A
SCHEMBL6970517 0.83 MIF (0.67) MIFCYP2C19NOS3NOS2LMNA
SCHEMBL957752 0.83 MIF (0.67) MIFCYP2C19NOS3NOS2LMNA
SCHEMBL4352912 0.83 MIF (0.43) MIFCYP2C19NOS3NOS2CYP2D6
SCHEMBL320976 0.82 MIF (0.42) MIFCYP2C19NOS3NOS2HTR2A
SCHEMBL1848616 0.82 EPHX1 (0.42) MIFCYP2C19TAAR1CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE33211-E REACTING THE PRODUCT OF ACETYLENE AND AN ORGANIC POLYOL WITH AN ISOCYANATE ALLIED-SIGNAL INC. (US) 1990-05-08 US claimed
US-20230229081-A1 A PHOTOCURABLE COMPOSITION HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2023-07-20 US disclosed
EP-4168466-A1 A PHOTOCURABLE COMPOSITION Huntsman Advanced Materials Licensing (Switzerland) GmbH (CH) 2023-04-26 EP disclosed
CN-115867588-A Photocurable composition 亨斯迈先进材料许可(瑞士)有限公司 2023-03-28 CN disclosed
CN-107870514-B Photosensitive resin composition 株式会社田村制作所 2022-09-16 CN disclosed
CN-114253075-A Photosensitive resin composition for ink jet 株式会社田村制作所 2022-03-29 CN disclosed
CN-114253070-A Photosensitive resin composition, cured product and electronic circuit board 株式会社田村制作所 2022-03-29 CN disclosed
WO-2021259610-A1 A PHOTOCURABLE COMPOSITION HUNTSMAN ADVANCED MATERIALS LICENSING (SWITZERLAND) GMBH (CH) 2021-12-30 WO disclosed
CN-113448170-A Photosensitive resin composition for inkjet and printed wiring board 株式会社田村制作所 2021-09-28 CN disclosed
CN-112020236-A Method for manufacturing wiring board having protective film 株式会社田村制作所 2020-12-01 CN disclosed
EP-0434741-A4 ULTRAVIOLET-CURABLE CATIONIC VINYL ETHER POLYURETHANE COATING COMPOSITIONS 1991-10-16 EP disclosed
EP-0437531-A4 ULTRAVIOLET-CURABLE BLENDS OF VINYL ETHER POLYURETHANES AND UNSATURATED ELASTOMERS AND COATINGS CONTAINING THE SAME 1991-08-07 EP disclosed
EP-0437531-A1 ULTRAVIOLET-CURABLE BLENDS OF VINYL ETHER POLYURETHANES AND UNSATURATED ELASTOMERS AND COATINGS CONTAINING THE SAME DESOTO INC. (US) 1991-07-24 EP disclosed
EP-0434741-A1 ULTRAVIOLET-CURABLE CATIONIC VINYL ETHER POLYURETHANE COATING COMPOSITIONS DSM N.V. (NL) 1991-07-03 EP disclosed
US-4956198-A VINYL ETHER TERMINATED POLYURETHANE FROM POLYCAPROLACTONES, POLYHEXANEDIOL CARBONATES, TRIMETHYLOLPROPANES, POLYOXYPROPYLENE DIAMINE AND AROMATIC DIISOCYANATES DESOTO, INC. (US) 1990-09-11 US disclosed
US-4952673-A Purification of copolymers of tetrahydrofuran and alkene oxides BASF AKTIENGESELLSCHAFT (DE) 1990-08-28 US disclosed
US-RE33211-E REACTING THE PRODUCT OF ACETYLENE AND AN ORGANIC POLYOL WITH AN ISOCYANATE ALLIED-SIGNAL INC. (US) 1990-05-08 US disclosed
WO-1990003988-A1 ULTRAVIOLET-CURABLE BLENDS OF VINYL ETHER POLYURETHANES AND UNSATURATED ELASTOMERS AND COATINGS CONTAINING THE SAME DESOTO, INC. (US) 1990-04-19 WO disclosed
WO-1990002614-A1 ULTRAVIOLET-CURABLE CATIONIC VINYL ETHER POLYURETHANE COATING COMPOSITIONS DESOTO, INC. (US) 1990-03-22 WO disclosed
US-4751273-A REACTION PRODUCT OF ACETYLENE AND POLYOL REACTED WITH ISOCYANATE AND CURED ALLIED-SIGNAL, INC. (US) 1988-06-14 US disclosed