SCHEMBL28448948

SCHEMBL28448948

CCOC(=O)c1c(C)nc2cccc(OCC(C)NC(=O)C3CCCCC3)c2c1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ACHE P22303 7/20 0.39
▸ CACNB4 O00305 6/20 0.39
▸ CACNA1A O00555 6/20 0.39
▸ CACNA1G O43497 6/20 0.39
▸ CACNG3 O60359 6/20 0.39
▸ CACNA1F O60840 6/20 0.39
▸ CACNA1H O95180 6/20 0.39
▸ CACNB3 P54284 6/20 0.39
▸ CACNA2D1 P54289 6/20 0.39
▸ CACNG7 P62955 6/20 0.39
▸ CACNA1B Q00975 6/20 0.39
▸ CACNA1D Q01668 6/20 0.39
▸ CACNB1 Q02641 6/20 0.39
▸ CACNG1 Q06432 6/20 0.39
▸ CACNB2 Q08289 6/20 0.39

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
SCHEMBL28460812 1.00 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDGAASMN1; SMN2
SCHEMBL28454801 1.00 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDGAASMN1; SMN2
SCHEMBL620207 0.91 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL619949 0.91 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL619950 0.91 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL618531 0.85 KDM4E (0.47) ALDH1A1KDM4EHPGDGAAACHE
SCHEMBL28448945 0.84 KMT2A (0.48) ALDH1A1SMN1; SMN2MAPT
SCHEMBL620978 0.83 KDM4E (0.49) ALDH1A1KDM4EHPGDGAASMN1; SMN2
SCHEMBL621555 0.83 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDGAASMN1; SMN2
SCHEMBL28449459 0.82 GABRP (0.46) ALDH1A1KDM4EHPGDGAASMN1; SMN2

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
CN-106107406-B Methods of improving the stability of sweetness enhancers and compositions comprising stable sweetness enhancers 弗门尼舍公司 2020-06-09 — — CN disclosed
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