SCHEMBL7088927

SCHEMBL7088927

OC1(CCN2CCCC2)CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.42
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMB5 P28074 1/20 0.35
PSMB2 P49721 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL7091537 0.98 HRH3 (0.39) HRH3MAPTALDH1A1POLBL3MBTL1
SCHEMBL29889633 0.95 HRH3 (0.42) HRH3MAPTALDH1A1POLBL3MBTL1
SCHEMBL4993541 0.84 POLB (0.42) POLBSMN1; SMN2
SCHEMBL4989467 0.81 POLB (0.44) POLBSMN1; SMN2
SCHEMBL7091824 0.77 HRH3 (0.30) HRH3
SCHEMBL23056837 0.76 HRH3 (0.46) HRH3MAPTALDH1A1POLBL3MBTL1
SCHEMBL11209430 0.74 HRH3 (0.44) HRH3MAPTALDH1A1POLBL3MBTL1
SCHEMBL7623444 0.74 SIGMAR1 (0.55) HRH3ALDH1A1POLBLMNATSHR
SCHEMBL595778 0.74 CYP2C19 (0.37) ALDH1A1TSHR
SCHEMBL23056803 0.73 HRH3 (0.42) HRH3MAPTALDH1A1POLBL3MBTL1

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