SCHEMBL7681633

SCHEMBL7681633

CCOC(=O)C1(C2c3[nH]c4ccc(Cl)cc4c3CCN2C(=O)c2ccncc2)CCC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
SIRT1 Q96EB6 1/20 0.45
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KIF11 P52732 8/20 0.43
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALOX15 P16050 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ABCG2 Q9UNQ0 5/20 0.40
ABCB1 P08183 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 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
SCHEMBL7680379 0.94 MAPT (0.51) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7677069 0.92 MEN1 (0.49) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7679575 0.91 MAPT (0.46) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7677783 0.90 ABCG2 (0.52) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7693228 0.89 MEN1 (0.48) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7684013 0.88 MAPT (0.51) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7855327 0.88 KIF11 (0.47) MEN1KMT2AMAPTSIRT1KIF11
SCHEMBL7683791 0.88 SIRT1 (0.56) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7674484 0.88 KMT2A (0.47) MEN1KMT2AMAPTLMNASIRT1
SCHEMBL7683312 0.87 MEN1 (0.46) MEN1KMT2AMAPTLMNASIRT1

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