SCHEMBL3137015

SCHEMBL3137015

Cc1ncc(OCC2(CNC(=O)O)CC2)cc1-c1cccc(N)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ECE1 P42892 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
MAOA P21397 1/20 0.33
KIT P10721 1/20 0.33
CSNK1D P48730 1/20 0.32
CYP4A11 Q02928 1/20 0.32
USP7 Q93009 1/20 0.32
MAP4K4 O95819 2/20 0.32
MERTK Q12866 1/20 0.32

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
SCHEMBL3147209 0.89 ABL1 (0.39) ABL1EGLN1CYP4A11
SCHEMBL3260960 0.85 EGLN1 (0.40) KDM4EALDH1A1EGLN1
SCHEMBL3144019 0.84 FYN (0.37) ABL1SMN1; SMN2MAOAKITUSP7
SCHEMBL3154853 0.84 CHRNB2 (0.45) ABL1MAP4K4
Hydrochloric Acid SCHEMBL3768581 0.83 FYN (0.37) ABL1SMN1; SMN2MAOAKITUSP7
SCHEMBL3147340 0.82 MAP4K4 (0.37) ABL1EGLN1MAP4K4
SCHEMBL3770703 0.82 SMN1; SMN2 (0.33) ABL1SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL3770701 0.80 ABL1 (0.36) ABL1SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL3141819 0.80 EGLN1 (0.48) EGLN1
SCHEMBL3137025 0.80 SMN1; SMN2 (0.36) ABL1SMN1; SMN2KDM4EALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed