SCHEMBL5317845

SCHEMBL5317845

Cc1ccc(Oc2ccc(Cl)nc2)c(O)c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.44
EGLN1 Q9GZT9 1/20 0.39
MPO P05164 1/20 0.38
TPO P07202 1/20 0.38
EPX P11678 1/20 0.38
LPO P22079 1/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL5316441 0.84 TTR (0.53) MPOTPOEPXLPOKDM4E
SCHEMBL5317344 0.82 KCNQ3 (0.42) MPOTPOEPXLPOHTR2A
SCHEMBL5318993 0.82 ACHE (0.50) ARMPOTPOEPXLPO
SCHEMBL12386586 0.79 AR (0.49) ARHTR2ASLC6A4KCNH2KDM4E
SCHEMBL16309243 0.78 AR (0.54) ARALDH1A1
SCHEMBL17930598 0.77 NPSR1 (0.49) KDM4EALDH1A1SMN1; SMN2
SCHEMBL10292484 0.74 TRPA1 (0.56) ARKDM4EALDH1A1GAA
SCHEMBL5318389 0.74 ALDH1A1 (0.53) ARKDM4EALDH1A1GAASMN1; SMN2
SCHEMBL5320413 0.74 MEN1 (0.41) ARHTR2ASLC6A4KCNH2ALDH1A1
SCHEMBL5319900 0.73 RAF1 (0.39) ARALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO claimed
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed