SCHEMBL38303

SCHEMBL38303

O=C=Nc1ccoc1N=C=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.40
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.31

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
SCHEMBL990504 0.76
SCHEMBL2320012 0.70 CYP3A4 (0.38) CYP3A4TRPA1TSHR
SCHEMBL28821279 0.69 ALOX5 (0.38) CYP3A4ALDH1A1HPGDTSHR
SCHEMBL29395383 0.64 CYP3A4 (0.64) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL15431 0.64 CYP3A4 (0.64) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL11334193 0.63 CYP3A4 (0.48) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL30244709 0.62 CYP3A4 (0.61) CYP3A4TRPA1ALDH1A1HPGDTDP1
Benzene SCHEMBL28766229 0.62 CYP3A4 (0.61) CYP3A4TRPA1ALDH1A1HPGDTDP1
Water SCHEMBL28526910 0.62 CYP3A4 (0.61) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL5577120 0.62 CYP3A4 (0.48) CYP3A4TRPA1ALDH1A1HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120137577-A Solvent-free two-component polyurethane adhesives 青岛优星橡塑制品有限公司 2025-06-13 CN claimed
CN-116891548-A Post-crosslinking aqueous adhesive special for lithium battery and preparation method and application thereof 成都硅宝科技股份有限公司 2023-10-17 CN claimed
CN-114592381-B Environment-friendly plastic-replacing glazing oil and application thereof in paper product packaging 深圳市摩码克来沃化学科技有限公司 2023-03-31 CN claimed
CN-114592381-A Environment-friendly alternative-plastic glazing oil and application thereof in paper product packaging 深圳市摩码克来沃化学科技有限公司 2022-06-07 CN claimed
CN-113831822-A Method for manufacturing high-performance polyurea composite material 成都上泰科技有限公司 2021-12-24 CN claimed
CN-110819023-B Low-dielectric-loss resin-based composite material and preparation method and application thereof 西安交通大学 2021-01-19 CN claimed
CN-110819023-A Low-dielectric-loss resin-based composite material and preparation method and application thereof 西安交通大学 2020-02-21 CN claimed
EP-2989138-B1 URETHANE ACRYLATES BASED ON 2,4,8,10-TETRAOXOSPIRO[5.5]UNDECANE-3,9-DIALKANOLS PERSTORP AB (SE) 2018-08-01 EP claimed
US-20170320887-A1 URETHANE ACRYLATES BASED ON 2,4,8,10-TETRAOXOSPIRO[5.5]-UNDECANE-3,9-DIALKANOLS PERSTORP AB (SE) 2017-11-09 US claimed
WO-2017048169-A1 PROCESS FOR PRODUCING A WATER DISPERSIBLE, AIR DRYING COATING BINDER PERSTORP AB (SE) 2017-03-23 WO claimed
EP-2989138-A1 URETHANE ACRYLATES BASED ON 2,4,8,10-TETRAOXOSPIRO[5.5]UNDECANE-3,9-DIALKANOLS PERSTORP AB (SE) 2016-03-02 EP claimed
WO-2014175802-A1 URETHANE ACRYLATES BASED ON 2,4,8,10-TETRAOXOSPIRO[5.5]UNDECANE-3,9-DIALKANOLS PERSTORP AB (SE) 2014-10-30 WO claimed
EP-4731713-A1 POLYALKYLENE GLYCOL TERMINATED POLY-CARBODIIMIDES, AND PROCESS FOR FORMING SAME Evoco Limited (CA) 2026-04-29 EP disclosed
US-20260062508-A1 POLYALKYLENE GLYCOL TERMINATED POLY-CARBODIIMIDES, AND PROCESS FOR FORMING SAME EVOCO LTD (CA) 2026-03-05 US disclosed
US-20260062511-A1 POLYALKYLENE GLYCOL TERMINATED POLY-CARBODIIMIDES, AND PROCESS FOR FORMING SAME EVOCO LTD (CA) 2026-03-05 US disclosed
US-12454595-B1 Polyalkylene glycol terminated poly-carbodiimides, and process for forming same Evoco Limited (CA) 2025-10-28 US disclosed
US-20110124755-A1 Polyisocyanurates AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-05-26 US disclosed
JP-2006257004-A METHOD FOR PRODUCING HETEROCYCLIC DIISOCYANATE TOYO KASEI KOGYO CO LTD 2006-09-28 JP disclosed
US-5374703-A Reaction a polyisocyanate, polyamino compound, and trimerization catalysts KABUSHIKI KAISHA KOBE SEIKO SHO (JP) 1994-12-20 US disclosed
WO-1989006251-A1 PRODUCTION OF POLYUREAS THE UNIVERSITY OF MANCHESTER INSTITUTE OF SCIENCE (GB) 1989-07-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170320887-A1 URETHANE ACRYLATES BASED ON 2,4,8,10-TETRAOXOSPIRO[5.5]-UNDECANE-3,9-DIALKANOLS ULK3, ULK2, DTYMK CYP3A4 2427/4885TRPA1 1311/4885ALDH1A1 455/4885
US-20110124755-A1 Polyisocyanurates SLC16A3, SLC16A8, METTL3 CYP3A4 2391/4885TRPA1 1853/4885ALDH1A1 2377/4885
US-12454595-B1 Polyalkylene glycol terminated poly-carbodiimides, and process for forming same ROS1, ALK, MEP1A CYP3A4 2106/4885TRPA1 3809/4885ALDH1A1 2052/4885
US-20260062508-A1 POLYALKYLENE GLYCOL TERMINATED POLY-CARBODIIMIDES, AND PROCESS FOR FORMING SAME PRMT1, ARGLU1, ARG1 CYP3A4 4325/4885TRPA1 4019/4885ALDH1A1 1712/4885
US-20260062511-A1 POLYALKYLENE GLYCOL TERMINATED POLY-CARBODIIMIDES, AND PROCESS FOR FORMING SAME PRMT1, LIG1, DCLRE1A CYP3A4 4291/4885TRPA1 4343/4885ALDH1A1 896/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.