SCHEMBL6828036

SCHEMBL6828036

COC(=O)c1c(Br)cc(Cl)c(OC)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.39
TSHR P16473 3/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
TPMT P51580 2/20 0.38
CYP3A4 P08684 2/20 0.38
TAS1R3 Q7RTX0 3/20 0.38
TAS1R1 Q7RTX1 3/20 0.38
TAS1R2 Q8TE23 2/20 0.38
HSD17B10 Q99714 1/20 0.38
CISD2 Q8N5K1 1/20 0.37
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GUSB P08236 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL31069592 0.83 POLB (0.41) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL17318733 0.82 POLB (0.46) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL30892255 0.82 POLB (0.46) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL16048561 0.81 POLB (0.45) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL17148693 0.78 TSHR (0.41) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL31573601 0.77 ALDH1A1 (0.51) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL21836913 0.77 ALDH1A1 (0.51) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL18786805 0.77 HPGD (0.47) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL18857938 0.75 POLB (0.49) POLBALDH1A1GAAKDM4EHPGD
SCHEMBL22833407 0.75 TSHR (0.44) POLBALDH1A1GAAKDM4ETSHR

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
WO-2004073612-A2 ESTROGEN RECEPTOR MODULATORS MERCK & CO. INC. (US) 2004-09-02 WO disclosed