SCHEMBL27482014

SCHEMBL27482014

CCCCOC(=O)N1CCC2OC2C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
POLB P06746 2/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 2/20 0.40
MMP13 P45452 3/20 0.40
MMP3 P08254 2/20 0.40
MMP9 P14780 2/20 0.40
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
GBA2 Q9HCG7 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MMP1 P03956 1/20 0.37
MMP7 P09237 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36

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
SCHEMBL3310770 0.89 SMN1; SMN2 (0.57) SMN1; SMN2POLBLMNAHPGDALDH1A1
SCHEMBL2180524 0.86 GAA (0.51) SMN1; SMN2POLBALDH1A1GAACHRM1
SCHEMBL22440438 0.80 SMN1; SMN2 (0.54) SMN1; SMN2POLBLMNAHPGDMMP13
SCHEMBL3708900 0.80 LMNA (0.54) SMN1; SMN2POLBLMNAHPGDALDH1A1
SCHEMBL3652385 0.80 LMNA (0.54) SMN1; SMN2POLBLMNAHPGDALDH1A1
SCHEMBL3652388 0.80 LMNA (0.54) SMN1; SMN2POLBLMNAHPGDALDH1A1
SCHEMBL2778566 0.80 SMN1; SMN2 (0.54) SMN1; SMN2POLBLMNAHPGDMMP13
SCHEMBL12468318 0.80 SMN1; SMN2 (0.51) SMN1; SMN2POLBLMNAHPGDMMP13
SCHEMBL12468883 0.80 SMN1; SMN2 (0.51) SMN1; SMN2POLBLMNAHPGDMMP13
SCHEMBL12468881 0.80 SMN1; SMN2 (0.51) SMN1; SMN2POLBLMNAHPGDMMP13

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-1171870-C Cysteine protease inhibitors ʷ��˿�������ȳ�ķ���޹�˾ 2004-10-20 CN disclosed
CN-1232399-A Cysteine protease inhibitors SMITHKLINE BEECHAM CORP (US) 1999-10-20 CN disclosed