SCHEMBL23735522

SCHEMBL23735522

CNC(=O)CCC(=O)NCCCCNC(=O)CCC(=O)NC

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
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 1/20 0.48
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44
FAAH O00519 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NAMPT P43490 1/20 0.42
HPGD P15428 1/20 0.42
DNM1 Q05193 1/20 0.41
EPHX2 P34913 2/20 0.41

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
SCHEMBL23735519 0.93 CASP2 (0.55) CASP2MEN1KMT2ANAAATSHR
SCHEMBL23735430 0.93 CASP2 (0.54) CASP2MEN1KMT2ANAAATSHR
SCHEMBL17740223 0.91 CASP2 (0.70) CASP2MEN1KMT2ANAAAFAAH
SCHEMBL19556882 0.91 MEN1 (0.71) CASP2MEN1KMT2ANAAATSHR
SCHEMBL2607880 0.91 NAAA (0.55) CASP2MEN1KMT2ANAAATSHR
SCHEMBL23735524 0.91 CASP2 (0.57) CASP2MEN1KMT2ANAAATSHR
SCHEMBL23735520 0.91 CASP2 (0.57) CASP2MEN1KMT2ANAAATSHR
SCHEMBL23735527 0.90 ALDH1A1 (0.50) CASP2MEN1KMT2ANAAATSHR
SCHEMBL22567031 0.88 PAOX (0.57) CASP2MEN1KMT2ANAAAALDH1A1
SCHEMBL19731479 0.88 FAAH (0.57) CASP2MEN1KMT2ANAAATSHR

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 1 patent. 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