SCHEMBL7979605

SCHEMBL7979605

CC(NC([NH])=O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.47
MTNR1B P49286 4/20 0.47
GAA P10253 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
PKM P14618 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
KDM4E B2RXH2 1/20 0.43
HTT P42858 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
TSHR P16473 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
POLB P06746 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL11384019 0.83 MTNR1A (0.57) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL17046780 0.78 POLB (0.41) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL25748786 0.77 MTNR1A (0.47) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL4634363 0.76 POLB (0.49) MTNR1AMTNR1BALDH1A1LMNAHPGD
SCHEMBL2963809 0.75 GAA (0.56) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL6804593 0.74 ALDH1A1 (0.41) MTNR1AMTNR1BGAAMEN1KMT2A
SCHEMBL6309709 0.74 MTNR1A (0.46) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL7750587 0.71 POLB (0.46) MTNR1AMTNR1BGAACYP1A2CYP2C9
Bicarbonate SCHEMBL3270191 0.71 GAA (0.52) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL10763403 0.71 SLC6A4 (0.44) MTNR1AMTNR1BGAACYP1A2CYP2C9

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-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed