SCHEMBL6679557

SCHEMBL6679557

CC(N[C]=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
GAA P10253 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
PKM P14618 1/20 0.38
CYP2C19 P33261 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 2/20 0.36

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
SCHEMBL10763403 0.74 SLC6A4 (0.44) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL10763892 0.72 MTNR1A (0.42) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL9353539 0.72 MTNR1A (0.42) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL1488230 0.72 MTNR1A (0.42) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL11402564 0.72 MAOA (0.52) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL24066716 0.72 MTNR1A (0.42) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL43675 0.72 MTNR1A (0.42) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL6309709 0.72 MTNR1A (0.46) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL6679558 0.72 MEN1 (0.47) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL19544761 0.71 SLC6A4 (0.42) MTNR1AMTNR1BGAAMEN1KMT2A

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
WO-2004041799-A1 5- (SUBSTITUTED PHENYL) -THIADIAZOLIDINE-3-ONES AND THEIR USE AS PTP1B ASTRAZENECA AB (SE) 2004-05-21 WO disclosed