SCHEMBL7829801

SCHEMBL7829801

CCOC(=O)CCc1c(C)oc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 3/20 0.40
DGAT2 Q96PD7 1/20 0.40
NLRP3 Q96P20 1/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC16A3 O15427 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL7828330 0.91 KMT2A (0.43) KMT2AMEN1MAPTPOLBLMNA
SCHEMBL7824483 0.87 MEN1 (0.41) KMT2AMEN1MAPTPOLBLMNA
SCHEMBL7832203 0.87 SLC16A3 (0.42) KMT2AMEN1MAPTPOLBHTT
SCHEMBL7831208 0.87 MAPT (0.39) KMT2AMEN1MAPTPOLBHTT
SCHEMBL8799254 0.86 KMT2A (0.40) KMT2AMEN1MAPTPOLBLMNA
SCHEMBL7832320 0.84 MAPT (0.42) KMT2AMEN1MAPTPOLBLMNA
SCHEMBL7827070 0.84 MAPT (0.40) KMT2AMEN1MAPTPOLBLMNA
SCHEMBL8800246 0.83 ALDH1A1 (0.38) KMT2AMEN1MAPTPOLBHTT
SCHEMBL7815783 0.82 MEN1 (0.44) KMT2AMEN1MAPTPOLBLMNA
SCHEMBL7827815 0.82 MEN1 (0.44) KMT2AMEN1MAPTPOLBLMNA

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
EP-0757682-B1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO (JP) 2001-06-20 EP disclosed
EP-0757682-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029907-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-09 WO disclosed