SCHEMBL27386752

SCHEMBL27386752

CC(C)(C)OC(=O)NCCCCc1cnccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.51
STK17B O94768 1/20 0.49
STK17A Q9UEE5 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
LATS1 O95835 2/20 0.44
DRD2 P14416 4/20 0.43
IDO1 P14902 2/20 0.43
HPGD P15428 3/20 0.43
HTT P42858 3/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
TP53 P04637 1/20 0.42
GLA P06280 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
SCHEMBL7867220 0.82 LATS1 (0.45) CYP3A4STK17BSTK17AMEN1KMT2A
SCHEMBL7866101 0.81 HPGD (0.46) CYP3A4STK17BSTK17AMEN1KMT2A
SCHEMBL2453025 0.81 IDO1 (0.50) CYP3A4STK17BSTK17AMEN1KMT2A
SCHEMBL25122811 0.79 CYP3A4 (0.54) CYP3A4MEN1KMT2ATDP1LATS1
SCHEMBL27370470 0.79 LMNA (0.44) CYP3A4STK17BSTK17AMEN1KMT2A
SCHEMBL25122892 0.78 CYP3A4 (0.56) CYP3A4MEN1KMT2ALMNATSHR
SCHEMBL27507343 0.78 CYP3A4 (0.71) CYP3A4NPSR1
SCHEMBL16738634 0.76 TDP1 (0.52) STK17BSTK17AMEN1KMT2ATDP1
SCHEMBL7866002 0.76 IDO1 (0.47) CYP3A4STK17BSTK17AMEN1KMT2A
SCHEMBL31568942 0.76 IDO1 (0.46) CYP3A4MEN1KMT2ALMNATSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1183142-C Cephalosporin antibiotics, composition and application ������ҩ��ҵ���޹�˾ 2005-01-05 CN disclosed
CN-1179963-C Cephalosporin antibiotics, composition and application ������ҩ��ҵ���޹�˾ 2004-12-15 CN disclosed
CN-1066735-C Cephalosporin antibiotics MICROCIDE PHARMACEUTICALS INC (US) 2001-06-06 CN disclosed
CN-1291612-A Cephalosporin antibiotics MAICROSEI MEDICINE CO (US) 2001-04-18 CN disclosed
CN-1291611-A Cephalosporin antibiotics MICROCIDE PHARMACEUTICALS INC (US) 2001-04-18 CN disclosed
CN-1204336-A Cephalosporin antibiotics MICROCIDE PHARMACEUTICALS INC (US) 1999-01-06 CN disclosed