SCHEMBL8312465

SCHEMBL8312465

O=Cc1ccc(OCCCCCOc2ccccc2OCCCCCOc2ccc(C=O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.56
MAPT P10636 8/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
HPGD P15428 4/20 0.56
LMNA P02545 3/20 0.56
KDM4E B2RXH2 1/20 0.53
DRD2 P14416 1/20 0.49
DRD1 P21728 1/20 0.49
DRD4 P21917 1/20 0.49
DRD5 P21918 1/20 0.49
DRD3 P35462 1/20 0.49
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.47
PPARA Q07869 1/20 0.47
KCNA3 P22001 2/20 0.47
L3MBTL1 Q9Y468 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
ATM Q13315 1/20 0.45
FDPS P14324 1/20 0.45
CYP1A2 P05177 1/20 0.45

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
SCHEMBL8204704 0.95 ALDH1A1 (0.62) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL3696420 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8373505 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8205008 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8549614 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8373486 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8315263 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL3113016 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8374769 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8192951 0.89 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HPGDLMNA

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-0597102-B1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF AND HYPOGLYCEMIC COMPOSITION YAMANOUCHI PHARMA CO LTD (JP) 1999-01-07 EP disclosed
US-5508296-A HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
EP-0597102-A1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1994-05-18 EP disclosed