SCHEMBL7368864

SCHEMBL7368864

COC(=O)c1ccc2c(OC)c(C(C)=O)[nH]c2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.61
PARP1 P09874 3/20 0.57
RAB9A P51151 1/20 0.52
DYRK1A Q13627 1/20 0.52
CSNK2A1 P68400 1/20 0.51
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 4/20 0.49
HSD17B10 Q99714 4/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
HPGD P15428 3/20 0.47
GAA P10253 2/20 0.47
USP2 O75604 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PKM P14618 2/20 0.46
GLA P06280 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL7419297 0.84 KIF11 (0.58) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL29708168 0.83 KIF11 (0.84) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL4725998 0.83 KIF11 (0.84) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL7357464 0.81 KIF11 (0.55) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL25986284 0.78 PARP1 (0.64) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL7419386 0.78 KIF11 (0.51) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL6009589 0.76 KIF11 (0.72) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL2483277 0.76 KIF11 (1.00) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL30522267 0.76 KIF11 (1.00) KIF11PARP1RAB9ADYRK1ACSNK2A1
SCHEMBL7419884 0.75 KIF11 (0.58) KIF11PARP1RAB9ADYRK1ACSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1192135-A2 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2002-04-03 EP disclosed
EP-1192132-A2 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2002-04-03 EP disclosed
WO-2000076970-A2 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2000-12-21 WO disclosed
WO-2000076971-A2 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2000-12-21 WO disclosed