SCHEMBL5671995

SCHEMBL5671995

O=C1NC(Cc2ccc(OCc3ccccc3)cc2)C(=O)N1CCN1CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.63
SSTR5 P35346 3/20 0.59
LTA4H P09960 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 2/20 0.51
EGFR P00533 2/20 0.51
HTT P42858 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM4C Q9H3R0 1/20 0.51
ALDH1A1 P00352 1/20 0.51
NPY1R P25929 1/20 0.51
KCNH2 Q12809 1/20 0.51
MCHR1 Q99705 1/20 0.51

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) HRH3SSTR5LTA4HNPC1RAB9A
SCHEMBL5670141 0.81 HRH3 (0.49) HRH3LTA4HKDM4EHTTKMT2A
SCHEMBL5670771 0.75 HRH3 (0.43) HRH3SMN1; SMN2KDM4EHTTALDH1A1
SCHEMBL21840806 0.73 HRH3 (0.60) HRH3RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL30438225 0.73 HRH3 (0.60) HRH3RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6750836 0.73 HRH3 (0.58) HRH3SSTR5LTA4HNPC1RAB9A
SCHEMBL4688871 0.72 LTA4H (0.97) HRH3LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL20748052 0.72 LTA4H (0.97) HRH3LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL3581020 0.71 NPC1 (0.87) HRH3LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL14970586 0.71 NPC1 (0.87) HRH3LTA4HNPC1RAB9ASMN1; SMN2

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 6 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
EP-1542686-A4 ARYL SUBSTITUTED HYDANTOIN COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO CELTIQUE SA (LU) 2006-10-18 EP disclosed
EP-1542686-A2 ARYL SUBSTITUTED HYDANTOIN COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS Euro-Celtique S.A. (LU) 2005-06-22 EP disclosed
WO-2004010950-A2 ARYL SUBSTITUTED HYDANTOIN COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2004-02-05 WO disclosed