SCHEMBL22965161

SCHEMBL22965161

CCOC(=O)CCCn1ncc2ncccc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TNF P01375 6/20 0.45
KDM4E B2RXH2 3/20 0.43
PTGDR2 Q9Y5Y4 3/20 0.43
GAA P10253 1/20 0.42
CTNNB1 P35222 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.41
CREBBP Q92793 1/20 0.41
TBXAS1 P24557 1/20 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
SCHEMBL22965217 0.82 KMO (0.51) KDM4EHSD17B10TBXAS1
SCHEMBL22965272 0.81 KMO (0.58) TNFKDM4EPTGDR2GAACTNNB1
SCHEMBL26067897 0.79 SLC9A1 (0.51) KDM4EGAAALDH1A1HTTLMNA
SCHEMBL22965233 0.78 TNF (0.45) TNFKDM4EGAACTNNB1ALDH1A1
SCHEMBL22965255 0.77 KDM4E (0.44) TNFKDM4EGAACTNNB1HSD17B10
SCHEMBL22965243 0.76 SLC9A1 (0.61) TNFKDM4EPTGDR2ALDH1A1HSD17B10
SCHEMBL30035836 0.75 SLC9A1 (0.49) KDM4EHSD17B10HPGDHTTLMNA
SCHEMBL23161358 0.75 KMO (0.35)
SCHEMBL1398456 0.74 MAPT (0.46) TNFKDM4ECTNNB1HSD17B10CREBBP
SCHEMBL1398484 0.74 CNR1 (0.47) TNFKDM4EGAACTNNB1HSD17B10

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-4234609-B1 METHODS FOR PURIFICATION, DETECTION AND QUANTIFICATION OF RESIDUAL PEI-BASED TRANSFECTION REAGENTS POLYPLUS TRANSFECTION (FR) 2024-07-17 EP disclosed
EP-4234609-A1 METHODS FOR PURIFICATION, DETECTION AND QUANTIFICATION OF RESIDUAL PEI-BASED TRANSFECTION REAGENTS PolyPlus Transfection (FR) 2023-08-30 EP disclosed
WO-2021023796-A1 COMPOSITIONS FOR TRANSFECTING A NUCLEIC ACID MOLECULE INTO A CELL COMPRISING HETEROCYCLIC COMPOUNDS GRAFTED TO A CATIONIC POLYMER, AND THEIR APPLICATIONS POLYPLUS TRANSFECTION (FR) 2021-02-11 WO disclosed