SCHEMBL21695694

SCHEMBL21695694

CC(=O)NCCCCNC(=O)CCCCC(=O)NCCCCNC(C)=O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.68
MAPK1 P28482 1/20 0.68
HIF1A Q16665 1/20 0.68
ADRA1A P35348 1/20 0.65
PAOX Q6QHF9 3/20 0.56
CASP2 P42575 1/20 0.54
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
TSHR P16473 1/20 0.52
FAAH O00519 3/20 0.52
NAAA Q02083 1/20 0.50
DNM1 Q05193 1/20 0.48
EPHX2 P34913 3/20 0.47
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SLC6A5 Q9Y345 1/20 0.46

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
SCHEMBL21695696 0.93 HIF1A (0.71) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL10825334 0.90 ADRA1A (0.85) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL16864576 0.90 KDM4E (0.61) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL861290 0.90 KDM4E (0.61) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL23735533 0.90 KDM4E (0.61) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL24067534 0.90 ADRA1A (0.85) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL19960974 0.90 CASP2 (0.71) KDM4EMAPK1HIF1AADRA1ACASP2
SCHEMBL13445262 0.90 KDM4E (0.61) KDM4EMAPK1HIF1AADRA1APAOX
SCHEMBL19960886 0.90 CASP2 (0.71) KDM4EMAPK1HIF1AADRA1ACASP2
SCHEMBL31631415 0.89 FAAH (0.61) KDM4EMAPK1HIF1AADRA1APAOX

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 2 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