SCHEMBL9487594

SCHEMBL9487594

CCCOC(Oc1ccccc1)=C(OCCC)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
ALDH1A1 P00352 4/20 0.48
MAPT P10636 4/20 0.48
KMT2A Q03164 3/20 0.48
HPGD P15428 2/20 0.48
MEN1 O00255 1/20 0.48
THRB P10828 1/20 0.48
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.40
MAOB P27338 1/20 0.40
FAAH O00519 6/20 0.39
TDP1 Q9NUW8 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
SCHEMBL9487571 0.85 MAPT (0.50) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL1598801 0.78 LMNA (0.56) LMNAALDH1A1MAPTKMT2AHPGD
Formaldehyde SCHEMBL28260770 0.75 LMNA (0.53) LMNAALDH1A1MAPTKMT2AHPGD
Acetic Acid Phenyl Ester SCHEMBL9772000 0.75 LMNA (0.53) LMNAALDH1A1MAPTKMT2AHPGD
SCHEMBL10585445 0.73 MAPT (0.49) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL28003882 0.73 ALDH1A1 (0.54) LMNAALDH1A1MAPTKMT2AHPGD
SCHEMBL4739376 0.73 MAPT (0.49) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL29031678 0.73 HCAR2 (0.59) LMNAALDH1A1MAPTKMT2AHPGD
SCHEMBL124445 0.72 MAPT (0.48) MAPTKMT2AHPGDMEN1GAA
SCHEMBL15842895 0.72 LMNA (0.50) LMNAALDH1A1MAPTKMT2AHPGD

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-0321618-B1 PHOTOSENSITIVE HARDENABLE COMPOSITIONS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1993-02-17 EP disclosed
US-4885229-A CONTAINING ACRYLATED ESTERS 501 DAICEL CHEMICAL INDUSTRIES LTD. (JP) 1989-12-05 US disclosed
EP-0321618-A1 Photosensitive hardenable compositions DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-06-28 EP disclosed