SCHEMBL7674484

SCHEMBL7674484

CCOC(=O)C1(C2c3[nH]c4ccc(Cl)cc4c3CCN2C(=O)c2ccoc2)CCC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
LMNA P02545 3/20 0.47
MAPT P10636 3/20 0.47
SIRT1 Q96EB6 1/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KIF11 P52732 10/20 0.41
TP53 P04637 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALOX15 P16050 1/20 0.40
ABCB1 P08183 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL7676645 0.91 KIF11 (0.38) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL7680379 0.90 MAPT (0.51) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7677069 0.89 MEN1 (0.49) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7853658 0.88 SIRT1 (0.46) LMNAMAPTSIRT1KIF11TP53
SCHEMBL7681633 0.88 MEN1 (0.48) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7677783 0.87 ABCG2 (0.52) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7683791 0.86 SIRT1 (0.56) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7680170 0.86 LMNA (0.52) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7679575 0.85 MAPT (0.46) KMT2AMEN1LMNAMAPTSIRT1
SCHEMBL7693228 0.84 MEN1 (0.48) KMT2AMEN1LMNAMAPTSIRT1

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-6350757-B1 Beta-carboline compounds LES LABORATOIRES SERVIER (FR) 2002-02-26 US disclosed