SCHEMBL6555327

SCHEMBL6555327

[O]CCC1=COc2ccccc2O1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.57
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
ALOX5 P09917 1/20 0.31
AHR P35869 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
SCHEMBL7198607 0.84 MTNR1A (0.53) MTNR1ASCN1ASCN2ASCN3AALOX5
SCHEMBL7203987 0.80 MTNR1A (0.53) MTNR1ASCN1ASCN2ASCN3AALOX5
SCHEMBL7202222 0.80 MTNR1A (0.57) MTNR1ASCN1ASCN2ASCN3AALOX5
SCHEMBL17002620 0.77 MTNR1A (0.53) MTNR1ASCN1ASCN2ASCN3AAHR
SCHEMBL7204577 0.75 MTNR1A (0.51) MTNR1ASCN1ASCN2ASCN3AAHR
SCHEMBL7203114 0.75 MTNR1A (0.47) MTNR1ASCN1ASCN2ASCN3AAHR
SCHEMBL7200454 0.73 MTNR1A (0.47) MTNR1A
SCHEMBL7203743 0.73 MTNR1A (1.00) MTNR1ASCN1ASCN2ASCN3A
SCHEMBL10862979 0.73 MTNR1A (0.50) MTNR1ASCN1ASCN2ASCN3A
SCHEMBL10861440 0.71 MTNR1A (0.48) MTNR1ASCN1ASCN2ASCN3A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1489077-A1 2-FURANCARBOXYLIC ACID HYDRAZIDES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2004-12-22 EP disclosed