SCHEMBL7828330

SCHEMBL7828330

CCOC(=O)Cc1c(C)oc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 3/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NLRP3 Q96P20 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GHSR Q92847 2/20 0.39

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
SCHEMBL7829801 0.91 KMT2A (0.41) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL8799254 0.89 KMT2A (0.40) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL7831438 0.88 AKR1B1 (0.42) KMT2AMAPTMEN1POLBHTT
SCHEMBL7832320 0.87 MAPT (0.42) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL7827815 0.85 MEN1 (0.44) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL7815783 0.85 MEN1 (0.44) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL7823605 0.85 KMT2A (0.41) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL8345228 0.84 PTGES (0.43) KMT2AMAPTMEN1POLBHTT
SCHEMBL7825342 0.84 MEN1 (0.40) KMT2AMAPTMEN1LMNAPOLB
SCHEMBL7823417 0.84 MEN1 (0.43) KMT2AMAPTMEN1LMNAPOLB

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