SCHEMBL8135248

SCHEMBL8135248

CCOC(=O)N1CCN(c2ccc(NC(=O)C3CCN(CC(=O)O)CC3)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
LMNA P02545 4/20 0.60
TDP1 Q9NUW8 2/20 0.58
HTT P42858 1/20 0.58
KMT2A Q03164 1/20 0.58
ALDH1A1 P00352 5/20 0.53
MAPK1 P28482 3/20 0.52
GAA P10253 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ABL1 P00519 1/20 0.50
POLB P06746 1/20 0.50
RIN1 Q13671 1/20 0.50
TSHR P16473 1/20 0.48
ME3 Q16798 1/20 0.48
ENPP2 Q13822 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL8147769 0.91 MAPT (0.59) MAPTLMNATDP1HTTKMT2A
SCHEMBL8144011 0.89 PTPN2 (0.62) MAPTLMNAHTTKMT2AALDH1A1
SCHEMBL8147771 0.87 MAPT (0.59) MAPTLMNATDP1HTTKMT2A
SCHEMBL8144002 0.85 ME3 (0.54) MAPTKMT2AALDH1A1MAPK1GAA
SCHEMBL7380393 0.84 PTPN2 (0.68) MAPTLMNATDP1HTTKMT2A
SCHEMBL7376708 0.84 MAPT (0.60) MAPTLMNATDP1HTTKMT2A
SCHEMBL7371765 0.80 ME3 (0.54) MAPTKMT2AALDH1A1MAPK1GAA
SCHEMBL7375251 0.80 PTPN2 (0.61) MAPTLMNAHTTKMT2AALDH1A1
SCHEMBL8135054 0.79 LMNA (0.49) MAPTLMNATDP1HTTKMT2A
Trifluoroacetic Acid SCHEMBL7376343 0.75 ME3 (0.48) MAPTKMT2AALDH1A1MAPK1GAA

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-6069143-A Fibrinogen receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-05-30 US disclosed