SCHEMBL7828350

SCHEMBL7828350

Cc1oc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1COC(=O)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.41
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
GPR35 Q9HC97 1/20 0.39
TSHR P16473 2/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GHSR Q92847 2/20 0.37
THRB P10828 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 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
SCHEMBL7823605 0.85 KMT2A (0.41) TP53ALDH1A1MEN1KMT2AMAPT
SCHEMBL7831834 0.84 SMN1; SMN2 (0.42) TP53ALDH1A1GPR35TSHRMEN1
SCHEMBL7832320 0.83 MAPT (0.42) TP53ALDH1A1TDP1GPR35MEN1
SCHEMBL8345228 0.83 PTGES (0.43) TP53MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7827960 0.82 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7816337 0.82 KDM4E (0.41) TP53ALDH1A1TDP1GPR35TSHR
SCHEMBL7826786 0.81 CYP2C19 (0.54) TP53ALDH1A1GPR35TSHRMAPT
SCHEMBL7824929 0.81 KMT2A (0.46) ALDH1A1TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL7827815 0.79 MEN1 (0.44) TP53ALDH1A1GPR35MEN1KMT2A
SCHEMBL7815783 0.79 MEN1 (0.44) TP53ALDH1A1GPR35MEN1KMT2A

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