SCHEMBL18316004

SCHEMBL18316004

CCN(CC)CCCN(CCCN(CC)CC)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.48
CA12 O43570 3/20 0.42
CA9 Q16790 3/20 0.42
CA1 P00915 2/20 0.42
PAOX Q6QHF9 1/20 0.39
ALDH1A1 P00352 2/20 0.38
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
LMNA P02545 3/20 0.34
ARG1 P05089 2/20 0.34
ARG2 P78540 2/20 0.34
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 2/20 0.33
TSHR P16473 2/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL10797859 0.86 NPSR1 (0.42) NPSR1CA12CA9CA1PAOX
SCHEMBL10799099 0.84 CA12 (0.54) NPSR1CA12CA9CA1ALDH1A1
SCHEMBL5845644 0.78 NPSR1 (0.42) NPSR1CA12CA9CA1PAOX
SCHEMBL42636 0.78 CA1 (0.56) CA12CA9CA1ALDH1A1CA2
SCHEMBL55496 0.78 CA1 (0.56) CA12CA9CA1ALDH1A1CA2
SCHEMBL293960 0.76 CA12 (0.48) CA12CA9CA1CA2MMP1
SCHEMBL35601 0.76 ALDH1A1 (0.41) PAOXALDH1A1LMNATSHRCYP1A2
Hydrochloric Acid SCHEMBL27402428 0.76 CA1 (0.54) CA12CA9CA1ALDH1A1CA2
Butane SCHEMBL9632378 0.76 CA1 (0.54) CA12CA9CA1ALDH1A1CA2
SCHEMBL177754 0.76 NPSR1 (0.47) NPSR1CA12CA9CA1PAOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20220144996-A1 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS EVONIK OPERATIONS GMBH (DE) 2022-05-12 US claimed
EP-3931177-A1 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS Evonik Operations GmbH (DE) 2022-01-05 EP claimed
US-11021561-B2 Amine composition useful for making polyurethane foam EVONIK OPERATIONS GMBH (DE) 2021-06-01 US claimed
WO-2020018087-A1 POLYURETHANE FOAM ADDITIVES TO IMPROVE FOAM ADHESION TO ORGANIC POLYMERS EVONIK DEGUSSA GMBH (DE) 2020-01-23 WO claimed
US-20180009930-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2018-01-11 US claimed
EP-3481878-B1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-05-22 EP disclosed
WO-2024022833-A1 METHOD FOR PREPARING FLEXIBLE SLABSTOCK POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-02-01 WO disclosed
WO-2024022832-A1 TERTIARY AMINO-AMIDE COMPOSITION USEFUL IN MAKING POLYURETHANE POLYMERS EVONIK OPERATIONS GMBH (DE) 2024-02-01 WO disclosed
EP-3310832-B1 ALDEHYDE SCAVENGERS MIXTURES FOR POLYURETHANE FOAMS EVONIK OPERATIONS GMBH (DE) 2023-10-11 EP disclosed
EP-4253442-A2 AMINE COMPOSITION USEFUL FOR MAKING STABLE POLYURETHANE FOAM SYSTEMS Evonik Operations GmbH (DE) 2023-10-04 EP disclosed
US-20180179318-A1 TRIMERIZATION CATALYSTS FROM STERICALLY HINDERED SALTS AND TERTIARY AMINES HAVING ISOCYANATE REACTIVE GROUPS EVONIK OPERATIONS GMBH (DE) 2018-06-28 US disclosed
EP-3310832-A1 ALDEHYDE SCAVENGERS MIXTURES FOR POLYURETHANE FOAMS Evonik Degussa GmbH (DE) 2018-04-25 EP disclosed
WO-2018013590-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK DEGUSSA GMBH (DE) 2018-01-18 WO disclosed
US-20180009930-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2018-01-11 US disclosed
WO-2016205436-A1 ALDEHYDE SCAVENGERS MIXTURES FOR POLYURETHANE FOAMS AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-12-22 WO disclosed
US-20160369035-A1 ALDEHYDE SCAVENGERS MIXTURES FOR POLYURETHANE FOAMS AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-12-22 US disclosed