SCHEMBL20561925

SCHEMBL20561925

NCCCCN(CCCCN)C(=O)CCC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
LMNA P02545 3/20 0.37
HDAC3 O15379 2/20 0.37
HDAC4 P56524 2/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC7 Q8WUI4 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC10 Q969S8 2/20 0.37
HDAC11 Q96DB2 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC9 Q9UKV0 2/20 0.37
HDAC5 Q9UQL6 2/20 0.37
BLM P54132 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
THRB P10828 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL19091931 0.94 LMNA (0.36) ACHECYP2D6NFKB1LMNAHDAC3
Hydrochloric Acid SCHEMBL17373887 0.90 BLM (0.45) ACHECYP2D6NFKB1LMNAHDAC3
SCHEMBL2401124 0.84 LMNA (0.42) ACHECYP2D6NFKB1LMNAHDAC3
SCHEMBL17530466 0.82 CYP2D6 (0.52) ACHECYP2D6NFKB1LMNAHDAC3
SCHEMBL7568696 0.81 NTRK2 (0.35) LMNAHDAC1HDAC6ALDH1A1
SCHEMBL9050492 0.81 ACHE (0.42) ACHELMNAHDAC3HDAC4HDAC1
SCHEMBL31040413 0.80 LMNA (0.54) ACHECYP2D6NFKB1LMNAHDAC3
SCHEMBL7734572 0.80 SOAT1 (0.48) KMT2AMEN1ALDH1A1CYP1A2KDM4E
SCHEMBL29579829 0.80 KDM4A (0.55) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL7737120 0.80 SOAT1 (0.48) KMT2AMEN1ALDH1A1CYP1A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3157978-B1 STRICTLY SEGMENTED THERMOPLASTIC ELASTOMERS AS BIODEGRADABLE BIOMATERIALS SYMO CHEM B V (NL) 2021-08-11 EP disclosed
US-10556994-B2 Strictly segmented thermoplastic elastomers as biodegradable biomaterials SYMO-CHEM B.V. (NL) 2020-02-11 US disclosed
US-20180334543-A1 STRICTLY SEGMENTED THERMOPLASTIC ELASTOMERS AS BIODEGRADABLE BIOMATERIALS SYMO-CHEM B.V. (NL) 2018-11-22 US disclosed