SCHEMBL9032175

SCHEMBL9032175

O=Cc1ccc(OC[C@@H]2CCCN2c2nc3ccccc3o2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.43
HTR3A P46098 1/20 0.43
ATP4A P20648 4/20 0.41
ATP4B P51164 4/20 0.41
LTA4H P09960 4/20 0.39
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
PTGES O14684 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTGS2 P35354 1/20 0.38
TLR9 Q9NR96 1/20 0.38
KCNH2 Q12809 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
SCHEMBL9032183 1.00 CHRNA7 (0.43) CHRNA7HTR3AATP4AATP4BLTA4H
SCHEMBL9032763 0.84 HPGD (0.53)
SCHEMBL9311188 0.84 HPGD (0.53)
SCHEMBL9311201 0.83 HPGD (0.43) CHRNA7HTR3AATP4AATP4B
SCHEMBL5021501 0.83 CHRNA7 (0.48) CHRNA7HTR3AALDH1A1TSHRLMNA
SCHEMBL8507531 0.79 PDE10A (0.47) CHRNA7
SCHEMBL8508526 0.79 PDE10A (0.47) CHRNA7
SCHEMBL9031383 0.78 ATP4A (0.41) ATP4AATP4BLTA4HALDH1A1LMNA
SCHEMBL9032154 0.78 ATP4A (0.41) ATP4AATP4BLTA4HALDH1A1LMNA
SCHEMBL9032163 0.78 ATP4A (0.41) ATP4AATP4BLTA4HALDH1A1LMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528734-B1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1996-10-23 EP disclosed
US-5330999-A Diabetes, obesity ADIR ET COMPAGNIE (FR) 1994-07-19 US disclosed
US-5296605-A 2,4-thiazolidinedione compounds ADIR ET COMPAGNIE (FR) 1994-03-22 US disclosed
US-5266582-A Antidiabetic agents ADIR ET COMPAGNIE (FR) 1993-11-30 US disclosed
EP-0528734-A1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-02-24 EP disclosed