SCHEMBL7279837

SCHEMBL7279837

OCC1CCCCN1CCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 7/20 0.60
SPHK1 Q9NYA1 7/20 0.60
OPRD1 P41143 1/20 0.57
GBA1 P04062 1/20 0.54

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
SCHEMBL29471350 1.00 SPHK2 (0.60) SPHK2SPHK1OPRD1GBA1
SCHEMBL27627908 0.95 SPHK2 (0.66) SPHK2SPHK1OPRD1GBA1
SCHEMBL25687586 0.91 SPHK1 (0.62) SPHK2SPHK1OPRD1
SCHEMBL27650694 0.88 OPRD1 (0.55) OPRD1
SCHEMBL25687560 0.88 ALDH1A1 (0.56) SPHK2SPHK1OPRD1
SCHEMBL18922677 0.86 SPHK2 (0.63) SPHK2SPHK1
SCHEMBL5888793 0.86 OPRD1 (0.55) OPRD1
SCHEMBL6797294 0.85 SPHK2 (0.62) SPHK2SPHK1
SCHEMBL25685938 0.85 SPHK2 (0.61) SPHK2SPHK1
SCHEMBL6797298 0.85 SPHK2 (0.62) SPHK2SPHK1

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-0429984-B1 Indole derivatives NISSHIN FLOUR MILLING CO (JP) 1997-07-23 EP disclosed
US-5124324-A Psychological disorders, 5-hydroxy tryptamine antagonists NISSHIN FLOUR MILLING CO., LTD. (JP) 1992-06-23 US disclosed
EP-0429984-A2 Indole derivatives NISSHIN FLOUR MILLING CO., LTD. (JP) 1991-06-05 EP disclosed