SCHEMBL2800932

SCHEMBL2800932

OCCC1=COc2ccccc2-c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
MTNR1A P48039 1/20 0.30

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
SCHEMBL7202222 0.65 MTNR1A (0.57) TDP1MTNR1A
SCHEMBL10728340 0.64 MAPK1 (0.41) TDP1
Ethylene Glycol SCHEMBL4334499 0.64 MEN1 (0.45) TDP1
SCHEMBL31023619 0.64 KDM4E (0.38) TDP1
SCHEMBL9376982 0.61 TDP1 (0.41) TDP1MTNR1A
SCHEMBL5693983 0.60 MAPK1 (0.61) TDP1
SCHEMBL19537981 0.60 MAPK1 (0.61) TDP1
SCHEMBL30969099 0.57 KDM4E (0.44) TDP1
SCHEMBL20756367 0.57 KDM4E (0.44) TDP1
SCHEMBL3058111 0.57 KDM4E (0.44) TDP1

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-2181989-B1 Process for the preparation of olopatadine SUMITOMO CHEMICAL CO (JP) 2013-05-22 EP disclosed
EP-2181989-A2 Process for the preparation of olopatadine Sumitomo Chemical Company, Limited (JP) 2010-05-05 EP disclosed
EP-2072507-A1 TERTIARY ALKYL ESTER OF OXODIBENZOXEPIN ACETIC ACID Sumitomo Chemical Company, Limited (JP) 2009-06-24 EP disclosed