SCHEMBL8153997

SCHEMBL8153997

COC(=O)CN1CCN(C2CC(C(=O)c3ccc(Cl)cc3)CC[N]2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 3/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MGLL Q99685 5/20 0.40
TSHR P16473 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL4670616 0.86 MGLL (0.41) KDM2BLMNAMAPTTP53L3MBTL1
SCHEMBL8109739 0.84 MGLL (0.45) LMNAMAPTTP53L3MBTL1MGLL
SCHEMBL8147774 0.83 KDM2B (0.55) KDM2BLMNAMAPTTP53L3MBTL1
SCHEMBL8149178 0.81 MGLL (0.48) KDM2BLMNAMAPTTP53L3MBTL1
SCHEMBL8140788 0.81 ALDH1A1 (0.48) LMNAMAPTTP53L3MBTL1MGLL
SCHEMBL8103874 0.80 LMNA (0.53) KDM2BLMNAMAPTTP53L3MBTL1
SCHEMBL8111407 0.80 LMNA (0.46) KDM2BLMNAMAPTTP53L3MBTL1
SCHEMBL8150423 0.80 LMNA (0.45) LMNAMAPTTP53L3MBTL1MGLL
SCHEMBL7325935 0.79 MGLL (0.46) KDM2BLMNAMAPTTP53L3MBTL1
SCHEMBL4671256 0.79 MGLL (0.46) KDM2BLMNAMAPTTP53L3MBTL1

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-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed