SCHEMBL9670872

SCHEMBL9670872

COc1ccc(C(=O)CCl)cn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.62
MAPT P10636 3/20 0.56
KDM4E B2RXH2 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MKNK1 Q9BUB5 1/20 0.51
MKNK2 Q9HBH9 1/20 0.51
GRIN2B Q13224 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
ALDH1A1 P00352 4/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
GSK3B P49841 2/20 0.44
OXTR P30559 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
GPR183 P32249 1/20 0.41
HIF1A Q16665 2/20 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
SCHEMBL2186062 0.84 NNMT (0.64) NNMTMAPTKDM4EMEN1KMT2A
SCHEMBL30543017 0.84 NNMT (0.64) NNMTMAPTKDM4EMEN1KMT2A
SCHEMBL1535155 0.83 NNMT (0.62) NNMTMAPTKDM4EMEN1KMT2A
SCHEMBL29786256 0.83 NNMT (0.62) NNMTMAPTKDM4EMEN1KMT2A
SCHEMBL21741497 0.83 NNMT (0.62) NNMTMAPTKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL30461874 0.83 NNMT (0.62) NNMTMAPTKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL9753848 0.81 NNMT (0.65) NNMTMAPTKDM4EMEN1KMT2A
Bromide SCHEMBL6116910 0.81 NNMT (0.60) NNMTMAPTKDM4EMEN1KMT2A
SCHEMBL2493127 0.80 NNMT (0.68) NNMTMAPTKDM4EMEN1KMT2A
SCHEMBL2154730 0.80 NNMT (0.68) NNMTMAPTKDM4EMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0506729-A1 PHARMACEUTICALLY ACTIVE OXAZOLE COMPOUNDS Beecham Group p.l.c. (GB) 1992-10-07 EP disclosed
WO-1991009856-A1 PHARMACEUTICALLY ACTIVE OXAZOLE COMPOUNDS BEECHAM GROUP PLC (GB) 1991-07-11 WO disclosed