SCHEMBL11355995

SCHEMBL11355995

CCCCCCCCCCCCN1/C=C/CCCCCCCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
GNAI3 P08754 2/20 0.34
GNAO1 P09471 2/20 0.34
GNAI1 P63096 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX5 P09917 2/20 0.33
NPC1 O15118 5/20 0.33
RAB9A P51151 5/20 0.33
HTT P42858 4/20 0.33
GALR3 O60755 2/20 0.33
POLB P06746 2/20 0.33
ATM Q13315 2/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL5992845 0.96 LTA4H (0.33) LTA4HGNAI3GNAO1GNAI1MEN1
SCHEMBL371279 0.91 GNAI3 (0.33) LTA4HGNAI3GNAO1GNAI1ALOX5
SCHEMBL23912452 0.85 GNAI3 (0.38) GNAI3GNAO1GNAI1NPC1RAB9A
SCHEMBL28042239 0.85 CYP1A2 (0.30)
SCHEMBL27451155 0.85 GNAI3 (0.38) GNAI3GNAO1GNAI1NPC1RAB9A
SCHEMBL28282304 0.85 GNAI3 (0.38) GNAI3GNAO1GNAI1NPC1RAB9A
SCHEMBL27450698 0.85 GNAI3 (0.38) GNAI3GNAO1GNAI1NPC1RAB9A
SCHEMBL28287505 0.85 GNAI3 (0.38) GNAI3GNAO1GNAI1NPC1RAB9A
SCHEMBL5174927 0.83 GNAI3 (0.35) GNAI3GNAO1GNAI1NPC1RAB9A
SCHEMBL11407357 0.81 HRH3 (0.32) HRH3LMNA

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-0027194-A1 Process for producing sodium bicarbonate and hydrogen chloride CHEMISCHE WERKE HÜLS AG (DE) 1981-04-22 EP disclosed