SCHEMBL6779535

SCHEMBL6779535

CC(=O)C1=C(O)C(=O)N(Cc2ccc(C)cc2)C1c1ccc(Br)cc1

nearest known ligand 0.80

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.80
KMT2A Q03164 5/20 0.80
CCR1 P32246 3/20 0.66
CCR2 P41597 2/20 0.66
USP7 Q93009 1/20 0.62
RXFP1 Q9HBX9 5/20 0.57
ATM Q13315 1/20 0.57
PPARG P37231 1/20 0.54
NCOR2 Q9Y618 1/20 0.54
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 3/20 0.54
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL6780926 0.94 MEN1 (0.68) MEN1KMT2ACCR1CCR2RXFP1
SCHEMBL6781607 0.89 MEN1 (1.00) MEN1KMT2AUSP7RXFP1ATM
SCHEMBL6776780 0.88 RXFP1 (0.66) MEN1KMT2ACCR1CCR2RXFP1
SCHEMBL6785309 0.87 MEN1 (0.79) MEN1KMT2ACCR1CCR2KDM4E
SCHEMBL6785761 0.87 MEN1 (0.71) MEN1KMT2ACCR1RXFP1KDM4E
SCHEMBL6776151 0.86 MEN1 (0.73) MEN1KMT2ACCR1CCR2USP7
SCHEMBL6781774 0.84 MEN1 (0.58) MEN1KMT2ACCR1CCR2USP7
SCHEMBL6781529 0.83 MEN1 (0.72) MEN1KMT2ACCR1CCR2USP7
SCHEMBL3705385 0.82 USP7 (0.79) MEN1KMT2ACCR1CCR2USP7
SCHEMBL6779215 0.81 RXFP1 (0.58) MEN1KMT2ACCR1CCR2RXFP1

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-6727275-B2 ANTIINFLAMMATORY, ANTIALLERGEN, AND ANTIASTHMATIC AGENTS UCB, S.A./N.V. (BE) 2004-04-27 US claimed