SCHEMBL7830992

SCHEMBL7830992

CCc1oc2c([N+](=O)[O-])cccc2c1C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PKM P14618 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
GPR35 Q9HC97 1/20 0.45
NPC1 O15118 1/20 0.44
MAPK1 P28482 1/20 0.44
KLK3 P07288 1/20 0.40
FBP1 P09467 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAOA P21397 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL7824675 0.72 TDP1 (0.42) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL8037995 0.72 LOXL2 (0.40) ALDH1A1MAPTMEN1KMT2ATSHR
SCHEMBL7815658 0.72 CYP3A4 (0.40) ALDH1A1TDP1TSHRNPC1HSD17B10
SCHEMBL7831575 0.72 TDP1 (0.48) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL7829809 0.72 TDP1 (0.44) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL7827473 0.72 TDP1 (0.44) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL7817261 0.72 GPR35 (0.47) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL7816217 0.71 GPR35 (0.47) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL4778868 0.71 GPR35 (0.63) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL15375875 0.71 TDP1 (0.46) ALDH1A1MAPTL3MBTL1MEN1KMT2A

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