SCHEMBL7091537

SCHEMBL7091537

OC1(CCN2CCCC2)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.39
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PSMB1 P20618 1/20 0.33
PSMB5 P28074 1/20 0.33
PSMB2 P49721 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL7088927 0.98 HRH3 (0.42) HRH3MAPTPOLBALDH1A1L3MBTL1
SCHEMBL29889633 0.93 HRH3 (0.42) HRH3MAPTPOLBALDH1A1L3MBTL1
SCHEMBL4989467 0.83 POLB (0.44) POLBSMN1; SMN2
SCHEMBL4993541 0.81 POLB (0.42) POLBSMN1; SMN2
SCHEMBL23056803 0.75 HRH3 (0.42) HRH3MAPTPOLBALDH1A1L3MBTL1
SCHEMBL7091824 0.74 HRH3 (0.30) HRH3
SCHEMBL23056837 0.73 HRH3 (0.46) HRH3MAPTPOLBALDH1A1L3MBTL1
SCHEMBL7623444 0.72 SIGMAR1 (0.55) HRH3POLBALDH1A1LMNATSHR
SCHEMBL11209430 0.71 HRH3 (0.44) HRH3MAPTPOLBALDH1A1L3MBTL1
SCHEMBL23011368 0.70 CYP2D6 (0.37) SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270562-A2 Cyclic alpha-amino-gamma-hydroxy-amides, process for their preparation and pharmaceutical compositions thereof Les Laboratoires Servier (FR) 2003-01-02 EP disclosed