SCHEMBL27813640

SCHEMBL27813640

CCOC(=O)C1Nc2ccc(Cl)cc2C1Br

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
POLB P06746 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.45
GAA P10253 1/20 0.45
ALOX15 P16050 3/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 2/20 0.41
CDC25B P30305 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
RECQL P46063 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
SCHEMBL27813550 0.84 MEN1 (0.46) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL14389278 0.81 MEN1 (0.46) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL13098046 0.80 MEN1 (0.45) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL27463958 0.79 CDC25B (0.57) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL27479516 0.79 CDC25B (0.57) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL6215376 0.77 POLB (0.77) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL13602973 0.75 MAPK1 (0.46) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL27677015 0.74 MEN1 (0.63) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL27792319 0.72 MEN1 (0.37) MEN1KMT2APOLBL3MBTL1GAA
SCHEMBL6769878 0.72 MEN1 (0.41) MEN1KMT2APOLBGAAMAPK1

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
CN-101842376-A Tetracyclic indole derivatives and being used for the treatment of or prophylaxis of viral infections SCHERING CORP 2010-09-22 CN disclosed