SCHEMBL8103919

SCHEMBL8103919

COC(=O)[C@H]1CCCN(C2CC(C(=O)c3ccc(Cl)cc3)CC[N]2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 3/20 0.47
MGLL Q99685 4/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.41
GLA P06280 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GRM5 P41594 1/20 0.40
MAPK1 P28482 2/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL8149178 0.84 MGLL (0.48) KDM2BMGLLMEN1KMT2ALMNA
SCHEMBL8109739 0.81 MGLL (0.45) MGLLMEN1KMT2ALMNAALDH1A1
SCHEMBL8153997 0.78 KDM2B (0.41) KDM2BMGLLMEN1KMT2ALMNA
SCHEMBL8103922 0.78 KDM2B (0.52) KDM2BMGLLMEN1KMT2ALMNA
SCHEMBL7325935 0.78 MGLL (0.46) KDM2BMGLLMEN1KMT2ALMNA
SCHEMBL4671256 0.78 MGLL (0.46) KDM2BMGLLMEN1KMT2ALMNA
SCHEMBL8140788 0.77 ALDH1A1 (0.48) MGLLMEN1KMT2ALMNAALDH1A1
SCHEMBL8150423 0.77 LMNA (0.45) MGLLMEN1KMT2ALMNAALDH1A1
SCHEMBL8105525 0.75 MGLL (0.43) MGLLMEN1KMT2ALMNA
SCHEMBL8111407 0.74 LMNA (0.46) KDM2BMGLLMEN1KMT2ALMNA

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