SCHEMBL8103874

SCHEMBL8103874

COC(=O)CN1CCN(N2CCC(C(=O)c3ccc(Cl)cc3)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
TP53 P04637 1/20 0.53
MAPT P10636 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MGLL Q99685 7/20 0.52
TSHR P16473 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM2B Q8NHM5 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KCNH2 Q12809 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL4670619 0.84 MGLL (0.55) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL8109746 0.81 MGLL (0.58) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL8153997 0.80 KDM2B (0.41) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL14637904 0.80 LMNA (0.59) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL8147775 0.80 KDM2B (0.64) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL28512371 0.80 LMNA (0.70) LMNAMAPTMGLLTSHRSMN1; SMN2
SCHEMBL8149182 0.77 MGLL (0.67) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL8140791 0.77 MGLL (0.62) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL14638479 0.76 MGLL (0.61) LMNATP53MAPTL3MBTL1MGLL
SCHEMBL8106361 0.76 LMNA (0.58) LMNATP53MAPTL3MBTL1MGLL

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
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed