SCHEMBL5510100

SCHEMBL5510100

COCCCN1CCOc2ccc(COC3CN(S(=O)(=O)c4ccc(C)cc4)[C@H](COCc4ccccc4)CC3c3ccc(OC)cc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.37
PKM P14618 4/20 0.37
MAPT P10636 4/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
MMP1 P03956 4/20 0.34
MMP9 P14780 4/20 0.34
MMP2 P08253 3/20 0.34
MMP3 P08254 2/20 0.34
MMP13 P45452 2/20 0.34
GAA P10253 1/20 0.34
ATM Q13315 1/20 0.33
MMP7 P09237 3/20 0.32
MMP12 P39900 2/20 0.32
MMP14 P50281 2/20 0.32
MMP15 P51511 2/20 0.32
MMP16 P51512 2/20 0.32
MMP26 Q9NRE1 2/20 0.32

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
SCHEMBL2913954 1.00 LMNA (0.37) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2925527 0.95 FKBP1A (0.38) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2924022 0.95 LMNA (0.38) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2919070 0.93 CASP3 (0.39) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2922299 0.91 NPC1 (0.34) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL3950592 0.91 NPC1 (0.34) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL3465107 0.90 LMNA (0.36) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2922334 0.90 NPC1 (0.35) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2920405 0.90 FKBP1A (0.36) LMNAPKMMAPTALDH1A1SMN1; SMN2
SCHEMBL2915001 0.90 FKBP1A (0.38) LMNAPKMMAPTALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863803-A2 SUBSTITUTED PIPERIDINES Speedel Experimenta AG (CH) 2007-12-12 EP disclosed
WO-2006103277-A2 2 , 4 , 5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2006-10-05 WO disclosed