SCHEMBL9729535

SCHEMBL9729535

CCC(NC(N)=O)N(CC)CC

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CAD P27708 1/20 0.34
FDPS P14324 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
THPO P40225 1/20 0.32
LMNA P02545 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
SCHEMBL186588 0.80 CHRNB2 (0.35) CA1CA2CADCYP1A2TSHR
SCHEMBL16737814 0.80 DNM1 (0.39) LMNA
Hydrochloric Acid SCHEMBL28335915 0.78 LMNA (0.36) CA1CA2CADCYP1A2TSHR
SCHEMBL9700328 0.77 PGR (0.32) FDPS
SCHEMBL27523663 0.76 CAD (0.35) CADFDPS
SCHEMBL3280973 0.74 TGFBR1 (0.43)
SCHEMBL3285064 0.74 TSHR (0.47) TSHR
Hydrochloric Acid SCHEMBL29162350 0.72 TGFBR1 (0.42)
Hydrochloric Acid SCHEMBL29008141 0.72 TSHR (0.45) TSHR
SCHEMBL7401448 0.71 KMT2A (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4253442-B1 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS EVONIK OPERATIONS GMBH (DE) 2026-04-29 EP claimed
US-12540224-B2 Process and composition for the production of flexible polyurethane foam EVONIK OPERATIONS GMBH (DE) 2026-02-03 US claimed
US-20260028445-A1 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS EVONIK OPERATIONS GMBH (DE) 2026-01-29 US claimed
EP-4562069-A1 TERTIARY AMINO-AMIDE COMPOSITION USEFUL IN MAKING POLYURETHANE POLYMERS Evonik Operations GmbH (DE) 2025-06-04 EP claimed
EP-4562070-A1 METHOD FOR PREPARING FLEXIBLE SLABSTOCK POLYURETHANE FOAM Evonik Operations GmbH (DE) 2025-06-04 EP claimed
CN-119630722-A Tertiary amino-amide compositions useful in the manufacture of polyurethane polymers 赢创运营有限公司 2025-03-14 CN claimed
EP-3481878-B1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-05-22 EP claimed
WO-2024022833-A1 METHOD FOR PREPARING FLEXIBLE SLABSTOCK POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-02-01 WO claimed
WO-2024022832-A1 TERTIARY AMINO-AMIDE COMPOSITION USEFUL IN MAKING POLYURETHANE POLYMERS EVONIK OPERATIONS GMBH (DE) 2024-02-01 WO claimed
EP-4253442-A2 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS Evonik Operations GmbH (DE) 2023-10-04 EP claimed
EP-3954722-A1 PROCESS AND COMPOSITION FOR THE PRODUCTION OF FLEXIBLE POLYURETHANE FOAM Evonik Operations GmbH (DE) 2022-02-16 EP claimed
EP-3931177-A1 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS Evonik Operations GmbH (DE) 2022-01-05 EP claimed
CN-113544115-A Amine compositions useful for preparing stable polyurethane foam systems 赢创运营有限公司 2021-10-22 CN claimed
CN-107922564-B Trimerization catalysts from sterically hindered salts and tertiary amines having isocyanate-reactive groups 赢创运营有限公司 2021-10-19 CN claimed
US-11021561-B2 Amine composition useful for making polyurethane foam EVONIK OPERATIONS GMBH (DE) 2021-06-01 US claimed
US-10759892-B2 Trimerization catalysts from sterically hindered salts and tertiary amines having isocyanate reactive groups EVONIK OPERATIONS GMBH (DE) 2020-09-01 US claimed
WO-2020018087-A1 POLYURETHANE FOAM ADDITIVES TO IMPROVE FOAM ADHESION TO ORGANIC POLYMERS EVONIK DEGUSSA GMBH (DE) 2020-01-23 WO claimed
EP-3481878-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM Evonik Degussa GmbH (DE) 2019-05-15 EP claimed
WO-2018013590-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK DEGUSSA GMBH (DE) 2018-01-18 WO claimed
US-20180009930-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2018-01-11 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-12540224-B2 Process and composition for the production of flexible polyurethane foam INTS9, PUF60, INTS6 CA1 4157/4885CA2 4811/4885CAD 1150/4885
US-20260028445-A1 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS RFC2, RFC3, PUF60 CA1 1294/4885CA2 1772/4885CAD 3272/4885

“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.