SCHEMBL5316441

SCHEMBL5316441

Oc1cc(Cl)ccc1Oc1ccc(Cl)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 5/20 0.53
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
NR1I2 O75469 1/20 0.53
LMNA P02545 1/20 0.53
PGR P06401 1/20 0.53
HSP90AA1 P07900 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
HSPA5 P11021 1/20 0.53
CBR1 P16152 1/20 0.53
TBXA2R P21731 1/20 0.53
SLC6A2 P23975 1/20 0.53
AGTR1 P30556 1/20 0.53
SLC6A3 Q01959 1/20 0.53
CHEK2 O96017 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL5317845 0.84 AR (0.44) KDM4EALDH1A1SMN1; SMN2MPOTPO
SCHEMBL5317344 0.84 KCNQ3 (0.42) TTRMAPTHPGDNR1I2LMNA
Soneclosan SCHEMBL29359126 0.81 TTR (0.66) TTRMAPTHPGDNR1I2LMNA
Soneclosan SCHEMBL465591 0.81 TTR (0.66) TTRMAPTHPGDNR1I2LMNA
SCHEMBL5316194 0.79 SLC6A2 (0.47) TTRMAPTSLC6A2SLC6A3MEN1
SCHEMBL10540653 0.76 TTR (0.83) TTRMAPTHPGDNR1I2LMNA
SCHEMBL4586762 0.75 TTR (0.63) TTRMAPTHPGDNR1I2LMNA
SCHEMBL11551188 0.75 LTA4H (0.50)
SCHEMBL14465585 0.75 TTR (0.58) TTRMAPTHPGDNR1I2LMNA
SCHEMBL13778174 0.75 TTR (0.58) TTRMAPTHPGDNR1I2LMNA

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
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