SCHEMBL6776151

SCHEMBL6776151

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

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.73
KMT2A Q03164 5/20 0.73
MDM2 Q00987 2/20 0.61
USP7 Q93009 1/20 0.58
RXFP1 Q9HBX9 4/20 0.53
ATM Q13315 1/20 0.53
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 2/20 0.50
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CCR1 P32246 1/20 0.49
CCR2 P41597 1/20 0.49
PPARG P37231 1/20 0.48
NCOR2 Q9Y618 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
ALOX12 P18054 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL6782138 0.90 KDM4E (0.59) MEN1KMT2AMDM2USP7RXFP1
SCHEMBL6784907 0.88 MEN1 (0.65) MEN1KMT2AMDM2RXFP1KDM4E
SCHEMBL6779535 0.86 MEN1 (0.80) MEN1KMT2AUSP7RXFP1ATM
SCHEMBL6781607 0.84 MEN1 (1.00) MEN1KMT2AUSP7RXFP1ATM
SCHEMBL6781529 0.81 MEN1 (0.72) MEN1KMT2AUSP7RXFP1ATM
SCHEMBL6780926 0.79 MEN1 (0.68) MEN1KMT2ARXFP1KDM4EALDH1A1
SCHEMBL3706089 0.79 USP7 (0.66) MEN1KMT2AMDM2USP7RXFP1
SCHEMBL3705385 0.78 USP7 (0.79) MEN1KMT2AMDM2USP7RXFP1
SCHEMBL6779640 0.78 ALDH1A1 (0.76) MEN1KMT2ARXFP1KDM4EALDH1A1
SCHEMBL3709475 0.77 KDM4E (0.59) MEN1KMT2AMDM2USP7RXFP1

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