SCHEMBL28388652

SCHEMBL28388652

COc1ccc(C(=O)OC(Cl)c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
NPC1 O15118 3/20 0.65
RAB9A P51151 3/20 0.65
POLB P06746 2/20 0.65
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
NPSR1 Q6W5P4 1/20 0.60
ALDH1A1 P00352 3/20 0.54
CES2 O00748 2/20 0.53
CES1 P23141 2/20 0.53
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
UTS2R Q9UKP6 1/20 0.49
CDK5 Q00535 2/20 0.49
CDK5R1 Q15078 2/20 0.49
PKM P14618 1/20 0.49
KDM4E B2RXH2 1/20 0.49
HPGD P15428 1/20 0.49
CYP3A4 P08684 1/20 0.48
ACP3 P15309 1/20 0.47

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
SCHEMBL10499313 0.94 NPC1 (0.61) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL5421978 0.85 TSHR (0.57) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL2037987 0.82 ESR1 (0.70) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL21025912 0.80 MAPT (0.63) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL28279141 0.80 CA1 (0.62) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL16602217 0.79 RAB9A (0.62) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL11478296 0.78 CA1 (0.60) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL9481140 0.78 ESR1 (0.59) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL8964973 0.78 MAPT (0.60) MAPTNPC1RAB9APOLBKMT2A
SCHEMBL11756033 0.78 MAPT (0.60) MAPTNPC1RAB9APOLBKMT2A

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-110950761-A Synthesis method of latamoxef 7-site side chain 山东金城柯瑞化学有限公司 2020-04-03 CN claimed
CN-110950761-A Synthesis method of latamoxef 7-site side chain 山东金城柯瑞化学有限公司 2020-04-03 CN disclosed
CN-110950761-A Synthesis method of latamoxef 7-site side chain 山东金城柯瑞化学有限公司 2020-04-03 CN disclosed