SCHEMBL15920164

SCHEMBL15920164

CCOc1ccc(NC(=S)N2CCC(C(O)c3ccccc3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 6/20 0.69
LMNA P02545 3/20 0.66
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
ALOX12 P18054 1/20 0.66
ALDH1A1 P00352 4/20 0.61
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL15920277 0.86 NPY2R (0.60) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15919866 0.82 NPY2R (1.00) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15919628 0.82 NPY2R (0.68) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15919871 0.81 NPY2R (0.62) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15919884 0.79 NPY2R (1.00) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15919899 0.78 NPY2R (0.77) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15919864 0.75 ALDH1A1 (0.64) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15920272 0.74 NPY2R (0.58) NPY2RLMNAMEN1KMT2AALOX12
SCHEMBL15920278 0.74 MAPT (0.54) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL15919891 0.74 NPY2R (0.81) NPY2RLMNAMEN1KMT2AALOX12

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-2014116684-A1 NON-PEPTIDIC NEUROPEPTIDE Y RECEPTOR MODULATORS ROBERTS EDWARD (US) 2014-07-31 WO disclosed