SCHEMBL4783223

SCHEMBL4783223

CCNCCN1CCN(CCNCC)CC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.54
PRMT6 Q96LA8 3/20 0.49
CARM1 Q86X55 2/20 0.44
PRMT8 Q9NR22 2/20 0.44
CYP2C19 P33261 3/20 0.41
MEN1 O00255 1/20 0.41
GLA P06280 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
PRMT1 Q99873 1/20 0.38
TP53 P04637 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
KDM1A O60341 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
KIF11 P52732 1/20 0.35
ALOX15 P16050 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL19071988 0.95 ACE2 (0.56) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL10282545 0.93 ACE2 (0.48) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL7730804 0.93 ACE2 (0.48) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL25737704 0.91 PRMT6 (0.60) ACE2PRMT6CARM1PRMT8PRMT1
SCHEMBL20028835 0.90
SCHEMBL5430626 0.90 PRMT6 (0.58) ACE2PRMT6CARM1PRMT8KMT2A
SCHEMBL21367124 0.89 ACE2 (0.50) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL13008045 0.89 ACE2 (0.50) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL16504283 0.89 ACE2 (0.50) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL13178507 0.87 PRMT6 (0.56) ACE2PRMT6CARM1PRMT8KMT2A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113501796-B Aminoethylated piperazine and preparation method thereof 大连理工大学 2022-08-26 CN disclosed
CN-113477052-B Aminoethylated piperazine, preparation method thereof, carbon dioxide absorbent and application thereof 大连理工大学 2022-05-24 CN disclosed
EP-2688935-B1 NOVEL GRADATED POLYMERS AND PROCESS FOR THE PREPARATION THEREOF GT ELEKTROTECHNISCHE PRODUKTE GMBH (DE) 2016-03-16 EP disclosed
EP-2688935-A1 NOVEL GRADATED POLYMERS AND PROCESS FOR THE PREPARATION THEREOF GT Elektrotechnische Produkte GmbH (DE) 2014-01-29 EP disclosed
EP-2524934-A2 Thermoplastic polyurethane urea with biocidal properties and methods for producing same GT Elektrotechnische Produkte GmbH (DE) 2012-11-21 EP disclosed
WO-2012126638-A1 NOVEL GRADATED POLYMERS AND PROCESS FOR THE PREPARATION THEREOF GT ELEKTROTECHNISCHE PRODUKTE GMBH (DE) 2012-09-27 WO disclosed
WO-2008030390-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2008-03-13 WO disclosed
WO-2008030390-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2008-03-13 WO disclosed