SCHEMBL8545975

SCHEMBL8545975

O=Cc1ccc(OC/C=C/COc2ccc(C=O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.52
▸ CYP2A6 P11509 1/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ LMNA P02545 2/20 0.52
▸ MAPT P10636 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ KDM4E B2RXH2 4/20 0.49
▸ RAB9A P51151 1/20 0.47
▸ ALDH1A3 P47895 1/20 0.47
▸ KMT2A Q03164 2/20 0.46
▸ STS P08842 1/20 0.45
▸ AOC3 Q16853 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ DRD1 P21728 1/20 0.42

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
SCHEMBL8545747 1.00 ALDH1A1 (0.52) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL8545742 1.00 ALDH1A1 (0.52) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL28529733 0.90 ALDH1A1 (0.53) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL7190561 0.88 ALDH1A1 (0.46) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL6689787 0.88 ALDH1A1 (0.50) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL7190568 0.88 ALDH1A1 (0.46) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL2559715 0.86 ALDH1A1 (0.52) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL7680410 0.83 KMT2A (0.45) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL7680402 0.83 KMT2A (0.45) ALDH1A1CYP2A6SMN1; SMN2LMNAMAPT
SCHEMBL9522631 0.83 PPARG (0.55) ALDH1A1CYP2A6SMN1; SMN2KDM4ERAB9A

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-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 — — EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 — — US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 — — EP disclosed
EP-0533933-A1 BISHETEROCYCLIC COMPOUND YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1993-03-31 — — EP disclosed
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