SCHEMBL5554909

SCHEMBL5554909

Cc1ccccc1C(=O)N(c1c[c]ccc1)c1nccs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
CYP3A4 P08684 1/20 0.37
ADORA2A P29274 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 3/20 0.36
GAA P10253 1/20 0.35
TP53 P04637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
USP2 O75604 1/20 0.33
MAPK1 P28482 1/20 0.33
PLA2G7 Q13093 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
NR3C1 P04150 1/20 0.32

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
SCHEMBL2726306 0.75 NR3C1 (0.45) KDM4ECYP3A4ADORA2ACYP2C19LMNA
SCHEMBL3201018 0.71 NPC1 (0.46) KDM4ELMNAGAATP53MAPK1
SCHEMBL8557058 0.69 FFAR2 (0.41) KDM4ELMNATP53ALDH1A1HPGD
SCHEMBL27930079 0.69 LMNA (0.50) KDM4ELMNAGAATP53ALDH1A1
SCHEMBL12503021 0.69 SCD (0.47) KDM4ELMNAGAAALDH1A1FFAR1
SCHEMBL3201982 0.68 TRPM8 (0.45) KDM4ELMNAGAATP53ALDH1A1
SCHEMBL2772989 0.68 LMNA (0.51) LMNATP53ALDH1A1GLAHPGD
SCHEMBL22074370 0.68 NOTUM (0.53) LMNATP53USP2MAPK1NPC1
SCHEMBL1896858 0.67 LMNA (0.53) LMNAALDH1A1GLAKMT2ANPSR1
SCHEMBL2727288 0.67 GAA (0.44) KDM4ECYP3A4ADORA2ACYP2C19LMNA

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
EP-1658288-B1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-12-05 EP claimed