SCHEMBL21695696

SCHEMBL21695696

CC(=O)NCCCCNC(=O)CCC(=O)NCCCCNC(C)=O

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.71
▸ KDM4E B2RXH2 1/20 0.71
▸ MAPK1 P28482 1/20 0.71
▸ ADRA1A P35348 1/20 0.61
▸ PAOX Q6QHF9 3/20 0.58
▸ CASP2 P42575 1/20 0.56
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ NAAA Q02083 1/20 0.52
▸ TSHR P16473 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ FAAH O00519 1/20 0.44
▸ KDM4A O75164 1/20 0.44
▸ TET2 Q6N021 1/20 0.44
▸ DOHH Q9BU89 1/20 0.44
▸ FOLH1 Q04609 1/20 0.43
▸ GAA P10253 1/20 0.43

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
SCHEMBL21695694 0.93 KDM4E (0.68) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL27137140 0.89 CASP2 (0.74) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL22211311 0.89 CASP2 (0.68) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL22211290 0.89 ADRA1A (0.74) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL10585208 0.89 HIF1A (0.64) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL860790 0.88 KDM4E (0.56) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL19958499 0.88 PAOX (0.81) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL22211260 0.88 PAOX (0.81) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL19150115 0.87 CASP2 (0.77) HIF1AKDM4EMAPK1ADRA1APAOX
SCHEMBL860791 0.87 KDM4E (0.94) HIF1AKDM4EMAPK1ADRA1APAOX

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
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