SCHEMBL14367237

SCHEMBL14367237

O=C(Nc1ccccc1O)[C@@H]1C[C@H]1c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 2/20 0.64
HDAC4 P56524 1/20 0.61
ALDH1A1 P00352 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
NAMPT P43490 1/20 0.58
LMNA P02545 1/20 0.58
GAA P10253 1/20 0.58
HTT P42858 1/20 0.58
HPGD P15428 1/20 0.54
NPC1 O15118 2/20 0.53
RAB9A P51151 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ROCK2 O75116 1/20 0.51
SCN3A Q9NY46 1/20 0.49
MAPK1 P28482 1/20 0.48

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
SCHEMBL21434218 0.85 NAMPT (0.48) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL12431142 0.81 DEGS1 (0.59) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL15706299 0.80 DEGS1 (0.82) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL2235336 0.80 HTT (0.57) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL6241013 0.78 HDAC4 (0.71) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL21522275 0.78 DEGS1 (1.00) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL20284448 0.78 DEGS1 (1.00) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL12218306 0.77 NPC1 (0.53) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL6366335 0.77 HDAC4 (0.55) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT
SCHEMBL6366332 0.77 HDAC4 (0.55) DEGS1HDAC4ALDH1A1SMN1; SMN2NAMPT

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
US-7294622-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2007-11-13 US disclosed