SCHEMBL28174993

SCHEMBL28174993

C=CC(C)(C(=O)ON1CCOCC1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
CNR2 P34972 1/20 0.39
KCNA5 P22460 2/20 0.37
CYP3A4 P08684 1/20 0.37
HIF1A Q16665 1/20 0.37
RAB9A P51151 3/20 0.36
TP53 P04637 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL15848617 0.72 KCNN4 (0.42) SMN1; SMN2CYP3A4HIF1AALDH1A1GAA
SCHEMBL27296765 0.71 SMN1; SMN2 (0.54) SMN1; SMN2LMNAOPRM1OPRD1CNR2
SCHEMBL7800907 0.70 MEN1 (0.44) SMN1; SMN2CYP3A4ALDH1A1CYP2C19
SCHEMBL2928012 0.69 ALDH1A1 (0.48) SMN1; SMN2CYP3A4HIF1AALDH1A1CYP2C9
SCHEMBL20557179 0.69 ALDH1A1 (0.48) SMN1; SMN2CYP3A4HIF1AALDH1A1CYP2C9
SCHEMBL27716048 0.69 SMN1; SMN2 (0.48) SMN1; SMN2LMNACNR2RAB9AALDH1A1
SCHEMBL226315 0.67 KMT2A (0.55) SMN1; SMN2LMNANPC1ALDH1A1HPGD
SCHEMBL10445923 0.67 SMN1; SMN2 (0.49) SMN1; SMN2LMNAOPRM1OPRD1KCNA5
SCHEMBL2128020 0.67 SMN1; SMN2 (0.52) SMN1; SMN2LMNAOPRM1OPRD1ALDH1A1
Ammonia Solution, Strong SCHEMBL11880905 0.66 KMT2A (0.54) SMN1; SMN2LMNANPC1ALDH1A1HPGD

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
CN-107466212-A Use the oligosaccharide composition of animal feed and its manufacture method 卡德纳生物股份有限公司 2017-12-12 CN disclosed
CN-107427042-A Oligosaccharide composition used as food ingredient and its preparation method 卡德纳生物股份有限公司 2017-12-01 CN disclosed
CN-107428789-A Oligosaccharide composition for nutritional composition and method for producing the same 卡德纳生物股份有限公司 2017-12-01 CN disclosed