SCHEMBL9312922

SCHEMBL9312922

O=Cc1ccc(OCC2Cc3cc4c(cc32)OCO4)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 2/20 0.38
CYP3A4 P08684 1/20 0.37
HTR1A P08908 1/20 0.37
GRIN2C Q14957 1/20 0.37
MIF P14174 1/20 0.36
MAOB P27338 3/20 0.35
PYGL P06737 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 3/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL9312614 0.93 ALDH1A1 (0.38) ALDH1A1HSD17B10TDP1HPGDMIF
SCHEMBL9429827 0.82 HPGD (0.61) HPGDMAOBPYGLKDM4E
SCHEMBL9311363 0.79 ALDH1A1 (0.46) ALDH1A1HPGDGRIN2CMIFMAOB
SCHEMBL9312276 0.76 ALDH1A1 (0.42) ALDH1A1HPGDMIFKDM4EMAPT
SCHEMBL9429040 0.75 PYGL (0.56) HPGDMAOBPYGL
SCHEMBL9429648 0.73 FFAR1 (0.48) ALDH1A1HSD17B10TDP1HPGDCYP3A4
SCHEMBL9393510 0.69 HPGD (0.65) ALDH1A1HSD17B10TDP1HPGDCYP3A4
SCHEMBL30023457 0.69 HPGD (0.65) ALDH1A1HSD17B10TDP1HPGDCYP3A4
SCHEMBL31708214 0.68 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EMAPTLMNA
SCHEMBL29209169 0.68 MAOB (0.57) ALDH1A1HSD17B10TDP1HPGDMAOB

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
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