SCHEMBL5670141

SCHEMBL5670141

O=C1NC(Cc2cccc(Oc3ccccc3)c2)C(=O)N1CCN1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.49
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 4/20 0.43
HTT P42858 2/20 0.43
POLB P06746 1/20 0.43
CCR5 P51681 1/20 0.43
HPGD P15428 2/20 0.43
CACNA1B Q00975 2/20 0.41
LTA4H P09960 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
CACNA1F O60840 1/20 0.40
CHRM2 P08172 1/20 0.40
ADRB1 P08588 1/20 0.40
DRD2 P14416 1/20 0.40
SLC6A2 P23975 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
HRH1 P35367 1/20 0.40
ADRA1B P35368 1/20 0.40
OPRM1 P35372 1/20 0.40

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
SCHEMBL5672105 0.90 HRH3 (0.50) HRH3KDM4EALDH1A1HTTPOLB
SCHEMBL5670771 0.89 HRH3 (0.43) HRH3KDM4EALDH1A1HTTPOLB
SCHEMBL11259867 0.81 ALDH1A1 (0.45) KDM4EALDH1A1HTTPOLBCCR5
SCHEMBL5671995 0.81 HRH3 (0.63) HRH3KDM4EALDH1A1HTTLTA4H
SCHEMBL11267710 0.74 CCR5 (0.47) KDM4EALDH1A1HTTPOLBCCR5
SCHEMBL5672391 0.73 KDM4E (0.49) HRH3KDM4EALDH1A1HTTHPGD
SCHEMBL11403843 0.72 FDFT1 (0.40) ALDH1A1HTTPOLBCCR5HPGD
SCHEMBL6496864 0.71 ALDH1A1 (0.73) HRH3KDM4EALDH1A1HTTHPGD
SCHEMBL11261726 0.70 LMNA (0.42) ALDH1A1HTTPOLBCCR5LTA4H
SCHEMBL6499571 0.69 ALDH1A1 (0.75) KDM4EALDH1A1HTTHPGDTDP1

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-1542686-A4 ARYL SUBSTITUTED HYDANTOIN COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO CELTIQUE SA (LU) 2006-10-18 EP claimed
EP-1542686-A2 ARYL SUBSTITUTED HYDANTOIN COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS Euro-Celtique S.A. (LU) 2005-06-22 EP claimed
WO-2004010950-A2 ARYL SUBSTITUTED HYDANTOIN COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2004-02-05 WO claimed