SCHEMBL14385364

SCHEMBL14385364

COc1c(Br)cc(Br)cc1Oc1c(Br)cc(Br)c(Br)c1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 9/20 0.76
▸ ALOX12 P18054 6/20 0.76
▸ AKR1B1 P15121 5/20 0.54
▸ CA2 P00918 2/20 0.47
▸ CA4 P22748 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.42
▸ HTT P42858 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CA1 P00915 1/20 0.38
▸ CA6 P23280 1/20 0.38
▸ ERN1 O75460 2/20 0.38
▸ TSHR P16473 1/20 0.37
▸ APOBEC3A P31941 1/20 0.37
▸ APOBEC3G Q9HC16 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
SCHEMBL14385526 0.87 ALOX15 (0.73) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL14385345 0.86 ALOX15 (1.00) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL14385530 0.84 ALOX15 (0.71) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL14385352 0.81 ALOX15 (0.62) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL30298319 0.77 ALOX15 (0.76) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL14385538 0.77 ALOX15 (0.72) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL30109400 0.71 MAPK1 (0.64) ALOX15ALOX12CA2CA4HSD17B10
SCHEMBL14385528 0.71 ALOX15 (0.69) ALOX15ALOX12AKR1B1HTTMEN1
SCHEMBL14385537 0.71 ALOX15 (0.45) ALOX15ALOX12AKR1B1CA2CA4
SCHEMBL30076189 0.70 ALOX15 (0.60) ALOX15ALOX12AKR1B1CA2CA4

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-2007086895-A9 ANTIBACTERIAL COMPOUNDS AND USES THEREOF PINNACLE PHARMACEUTICALS (US) 2007-11-08 — — WO disclosed
WO-2007086895-A2 ANTIBACTERIAL COMPOUNDS AND USES THEREOF PINNACLE PHARMACEUTICALS (US) 2007-08-02 — — WO disclosed
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