SCHEMBL58661

SCHEMBL58661

O=C=NCCCCCCCN=C=O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.38
NAAA Q02083 1/20 0.38
GSK3B P49841 1/20 0.36
TRPA1 O75762 4/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
BACH1 O14867 1/20 0.32
MAFK O60675 1/20 0.32
EGFR P00533 1/20 0.32
PTGS2 P35354 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 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
SCHEMBL4251350 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL2231808 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL101467 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL1477623 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL10809632 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL8742957 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL3238884 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL43799 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL15038 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL5720451 1.00 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1

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 3762 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026100731-A1 COMPOSITION FOR OPTICAL MATERIAL, POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND LENS 三井化学株式会社 2026-05-15 WO claimed
US-20260015454-A1 HIGH PERFORMANCE, AMBIENT CURE POLYURETHANES COMPRISING POLYCAPROLACTONE POLYOLS INGEVITY UK LTD (GB) 2026-01-15 US claimed
US-12500079-B2 Semiconductor device manufacturing method SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-12-16 US claimed
EP-4594381-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE Ingevity UK Ltd (GB) 2025-08-06 EP claimed
EP-4596599-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, METHOD FOR PRODUCING SAME, AND OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2025-08-06 EP claimed
US-20250243313-A1 POLYCAPROLACTONE POLYOLS, ELASTOMERS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-31 US claimed
US-20250230274-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 US claimed
WO-2025149744-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 WO claimed
CN-120092033-A Novel polyurethane or polyurethane-urea compositions with enhanced low temperature properties 英格维蒂英国有限公司 2025-06-03 CN claimed
CN-119923423-A Polymerizable composition for optical material, method for producing same, and optical material 三井化学株式会社 2025-05-02 CN claimed
US-6353041-B1 PLASTICS FOR SEALING ROOTS OF TEETH KERR CORPORATION 2002-03-05 US claimed
EP-0624612-A1 Biostable polyurethane and medical article therefrom Becton, Dickinson and Company (US) 1994-11-17 EP claimed
US-5159051-A Tertiary amines in polymer chain; complexes; antithrombogenic agents BECTON, DICKINSON AND COMPANY (US) 1992-10-27 US claimed
CN-1037905-A URETHANE ACRYLATE COMPOUNDS AND COMPOSITIONS M & T CHEMICALS INC (US) 1989-12-13 CN claimed
US-4704303-A PHOTOPOLYMERIZATION CREATIVE NAIL DESIGN, A CORP. OF CA 1987-11-03 US claimed
US-4505983-A BINDERS, ISOCYANATE-ACTIVE HYDROGEN COMPOUND REACTION PRODUCT DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1985-03-19 US claimed
US-4384101-A EPOXIDE, ISOCYANATE, TRIALLYL CYANURATE AS CROSSLINKER FOR THERMOSETTING ELECTRICAL INSULATION BBC BROWN, BOVERI & COMPANY, LIMITED (CH) 1983-05-17 US claimed
US-4321350-A Process for the catalytic setting of polyurethane molding compositions GAMBRO DIALYSATOREN KG (DE) 1982-03-23 US claimed
US-4105622-A PROCESS FOR THE PREPARATION OF FLAME RETARDANT THERMOPLASTIC RESIN COMPOSITIONS DAINIPPON INC. & CHEMICALS INC. (JP) 1978-08-08 US claimed
US-4100118-A POLYGLYCIDYL ESTER OF A FATTY ACID, ISOCYANATE COMPOUND AND CURING CATALYST, THERMAL RESISTANCE, THERMAL SHOCK RESISTANCE HITACHI, LTD. (JP) 1978-07-11 US claimed