SCHEMBL28965219

SCHEMBL28965219

CCCOc1cc(C=O)ccc1C=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.56
▸ ALDH1A1 P00352 12/20 0.50
▸ HPGD P15428 8/20 0.47
▸ HTT P42858 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TSHR P16473 1/20 0.46
▸ MAPT P10636 6/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TDP1 Q9NUW8 3/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ TRIM24 O15164 1/20 0.42
▸ ALDH5A1 P51649 1/20 0.42
▸ ABAT P80404 1/20 0.42
▸ TRIM33 Q9UPN9 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL26908625 0.92 FDPS (0.54) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL15087786 0.90 FDPS (0.53) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL18886645 0.89 FDPS (0.51) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL29184154 0.89 FDPS (0.51) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL27821639 0.89 FDPS (0.51) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL28271354 0.89 FDPS (0.51) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL22160238 0.87 FDPS (0.56) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL22160252 0.86 FDPS (0.54) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL5882634 0.86 FDPS (0.69) FDPSALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL4363481 0.86 ALDH1A1 (0.67) FDPSALDH1A1HPGDTSHRMAPT

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
CN-115746230-A Preparation method and application of boric acid functionalized magnetic porous covalent organic polymer 江苏大学 2023-03-07 — — CN claimed
CN-115746230-A Preparation method and application of boric acid functionalized magnetic porous covalent organic polymer 江苏大学 2023-03-07 — — CN disclosed
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