SCHEMBL9865283

SCHEMBL9865283

CC(SCC/N=C(/NCCCc1c[nH]cn1)NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 2/20 0.36
SCN2A Q99250 2/20 0.36
HRH2 P25021 4/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 2/20 0.35
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HRH4 Q9H3N8 2/20 0.33
MTNR1B P49286 1/20 0.33
EBP Q15125 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
EPHX2 P34913 2/20 0.31
MCL1 Q07820 1/20 0.31

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
SCHEMBL9865287 1.00 SCN5A (0.36) SCN5ASCN2AHRH2RAB9ASMN1; SMN2
SCHEMBL9865291 0.93 HRH2 (0.36) SCN5ASCN2AHRH2HRH4
SCHEMBL9866696 0.89 SCN5A (0.42) SCN5ASCN2AHRH2RAB9ASMN1; SMN2
SCHEMBL9866702 0.89 SCN5A (0.42) SCN5ASCN2AHRH2RAB9ASMN1; SMN2
SCHEMBL9866987 0.86 EBP (0.36) SCN5ASCN2AHRH2RAB9ASMN1; SMN2
SCHEMBL7431296 0.86 EPHX2 (0.41) SCN5ASCN2AHRH2RAB9ANPC1
SCHEMBL7431291 0.86 EPHX2 (0.41) SCN5ASCN2AHRH2RAB9ANPC1
SCHEMBL9866763 0.85 NPC1 (0.42) SCN5ASCN2AHRH2RAB9ASMN1; SMN2
SCHEMBL9867435 0.85 NPC1 (0.42) SCN5ASCN2AHRH2RAB9ASMN1; SMN2
SCHEMBL9866135 0.85 EPHX2 (0.41) SCN5ASCN2AHRH2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5021431-A H-1 antagonist, h-2 agonist for treating hypertension, cardiac disease or arterial occlusion HEUMANN PHARMA GMBH & CO. (DE) 1991-06-04 US disclosed
EP-0199845-A1 Imidazolylalkylguanidin derivatives, process for their preparation and pharmaceutical compositions containing them HEUMANN PHARMA GMBH & CO (DE) 1986-11-05 EP disclosed