SCHEMBL29007209

SCHEMBL29007209

CC(=O)N[C@@H](CSCCCCO)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ICMT O60725 1/20 0.40
▸ GNPAT O15228 1/20 0.36
▸ NOS2 P35228 1/20 0.36
▸ TGFBR1 P36897 1/20 0.35
▸ PRNP P04156 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ TLR2 O60603 1/20 0.34
▸ FOLH1 Q04609 1/20 0.34

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
SCHEMBL10043024 0.95 MAPT (0.47) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL27075214 0.95 MAPT (0.47) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL21144523 0.90 MAPT (0.52) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL15794761 0.88 MAPT (0.50) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL15794762 0.88 MAPT (0.50) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL9545182 0.85 ICMT (0.53) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL9119016 0.85 ICMT (0.53) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL19927712 0.85 ICMT (0.53) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL19927710 0.85 ICMT (0.53) MAPTALDH1A1KDM4ETHRBALOX15
SCHEMBL9545188 0.85 ICMT (0.53) MAPTALDH1A1KDM4ETHRBALOX15

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-116148368-A Method for detecting various environmental pollutants and oxidative damage markers in urine 华中科技大学 2023-05-23 — — CN claimed
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