SCHEMBL754069

SCHEMBL754069

COCNC(=O)c1oc(C)cc1Cc1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 5/20 0.41
ALDH1A1 P00352 3/20 0.41
MMP1 P03956 2/20 0.41
MMP2 P08253 2/20 0.41
POLB P06746 3/20 0.39
CNR2 P34972 3/20 0.39
GPR55 Q9Y2T6 2/20 0.39
CNR1 P21554 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
KMT2A Q03164 1/20 0.38
RELA Q04206 1/20 0.38

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
SCHEMBL2484219 0.87 ALDH1A1 (0.39) ALDH1A1POLBCNR2CNR1GAA
SCHEMBL27756470 0.84 MAPK14 (0.36) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL756036 0.83 MAPK14 (0.36) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL756034 0.83 TP53 (0.39) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL753007 0.82 MAPK14 (0.35) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL756035 0.82 LMNA (0.35) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL755219 0.79 CNR2 (0.44) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL10290766 0.79 CNR2 (0.44) ALDH1A1POLBCNR2GPR55CNR1
SCHEMBL752953 0.77 CCNT1 (0.35) MMP1CNR2GPR55CNR1LMNA
SCHEMBL18531594 0.77 CNR2 (0.42) ALDH1A1POLBCNR2GPR55CNR1

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-1422218-B1 ANTIVIRAL AGENT SHIONOGI & CO (JP) 2012-03-21 EP disclosed