SCHEMBL7825337

SCHEMBL7825337

CCOC(=O)Cc1c(C)oc2c(N)cccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.44
KDM4E B2RXH2 3/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40
AHR P35869 1/20 0.40
PKM P14618 1/20 0.40
MAPT P10636 2/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
CDC25B P30305 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
ABCB1 P08183 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
SCHEMBL7828927 0.87 ALDH1A1 (0.46) CHEK1KDM4ELMNAALDH1A1HSD17B10
SCHEMBL7816604 0.80 GPR35 (0.43) KDM4ELMNAALDH1A1PKMMAPT
SCHEMBL23117350 0.77 PLK1 (0.55) KDM4ELMNAALDH1A1HSD17B10AHR
SCHEMBL7826135 0.76 ALDH1A1 (0.35) KDM4EALDH1A1HSD17B10PKMNPC1
SCHEMBL29322303 0.76 PKM (0.46) CHEK1KDM4EALDH1A1HSD17B10AHR
SCHEMBL7828330 0.75 KMT2A (0.43) KDM4ELMNAALDH1A1HSD17B10MAPT
SCHEMBL7822767 0.75 HPGD (0.42) KDM4ELMNAALDH1A1HSD17B10PKM
SCHEMBL29321733 0.75 SMN1; SMN2 (0.52) CHEK1LMNAALDH1A1HSD17B10PKM
SCHEMBL28118721 0.74 CHEK1 (0.50) CHEK1KDM4ELMNAALDH1A1HSD17B10
SCHEMBL7816913 0.74 NPC1 (0.45) KDM4ELMNAALDH1A1HSD17B10AHR

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
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
WO-1995029907-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-09 WO disclosed