SCHEMBL7829809

SCHEMBL7829809

Cc1oc2c([N+](=O)[O-])cccc2c1CN

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.44
GPR35 Q9HC97 2/20 0.44
ALDH1A1 P00352 7/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPK1 P28482 2/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 1/20 0.40
HSD17B10 Q99714 1/20 0.39
MAOA P21397 1/20 0.38
KLK3 P07288 1/20 0.37
FBP1 P09467 1/20 0.36
KDM4E B2RXH2 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL7817261 0.85 GPR35 (0.47) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7827473 0.85 TDP1 (0.44) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL8344224 0.83 TDP1 (0.42) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7826124 0.80 ALDH1A1 (0.60) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL8799151 0.79 GPR35 (0.41) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7816604 0.78 GPR35 (0.43) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7831575 0.77 TDP1 (0.48) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7823621 0.77 TDP1 (0.54) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7827949 0.75 TDP1 (0.46) TDP1GPR35ALDH1A1MAPTMEN1
SCHEMBL7824675 0.74 TDP1 (0.42) TDP1GPR35ALDH1A1MAPTMEN1

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