SCHEMBL7828389

SCHEMBL7828389

Cc1oc2c(NC(=O)c3c(Cl)ccc(NC(=O)CN(C)C)c3Cl)cccc2c1C(C)(C)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.35
POLB P06746 1/20 0.33
GHSR Q92847 2/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 2/20 0.32
LMNA P02545 2/20 0.32
GPR35 Q9HC97 1/20 0.32
MAPK14 Q16539 1/20 0.32
ALDH1A1 P00352 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
USP2 O75604 1/20 0.31
JAK1 P23458 1/20 0.31

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
SCHEMBL7827494 0.88 PARP14 (0.37) PARP14POLBGHSRMEN1KMT2A
SCHEMBL8345841 0.87 GPR35 (0.39) PARP14POLBMEN1KMT2APDK1
SCHEMBL7831900 0.86 MAPT (0.40) PARP14GHSRMEN1KMT2AL3MBTL1
SCHEMBL7824213 0.82 RAB9A (0.41) POLBMEN1KMT2APDK1PDK2
SCHEMBL8801824 0.82 GHSR (0.35) PARP14GHSRMEN1KMT2AL3MBTL1
SCHEMBL8345039 0.81 PDE4D (0.41) POLBMEN1KMT2AMAPTLMNA
SCHEMBL7827083 0.80 TYK2 (0.47) POLBPDK1PDK2PDK3PDK4
SCHEMBL7826683 0.79 MAPT (0.43) PARP14POLBMEN1KMT2AMAPT
SCHEMBL7816537 0.78 GPR35 (0.41) POLBGHSRPDK1PDK2PDK3
SCHEMBL8799382 0.77 TYK2 (0.37) GHSRKMT2AMAPTLMNAGPR35

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-0757682-B1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO (JP) 2001-06-20 EP disclosed
US-5858995-A ADMINISTERING TO HUMANS AND ANIMALS IN THE TREATMENT OF DISEASES CAUSED BY ABNORMAL BONE METABOLISM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-01-12 US 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