SCHEMBL7182510

SCHEMBL7182510

O=C(c1cc(Br)cc(Br)c1O)c1cc(Br)cc(Br)c1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C4 P17516 2/20 0.72
AKR1C3 P42330 2/20 0.72
AKR1C2 P52895 2/20 0.72
AKR1C1 Q04828 2/20 0.72
CYP3A4 P08684 1/20 0.59
TSHR P16473 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
MEN1 O00255 3/20 0.55
HTT P42858 3/20 0.55
KMT2A Q03164 3/20 0.55
LMNA P02545 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2C9 P11712 2/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
EGFR P00533 1/20 0.55
ERBB2 P04626 1/20 0.55
LCK P06239 1/20 0.55
PTGS1 P23219 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL29387062 0.84 AKR1C3 (1.00) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL330545 0.84 AKR1C3 (1.00) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL10701348 0.82 AKR1C3 (0.61) AKR1C4AKR1C3AKR1C2AKR1C1MEN1
SCHEMBL895511 0.82 AKR1C4 (0.67) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL9019697 0.82 AKR1C3 (0.96) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
Hydrochloric Acid SCHEMBL11781789 0.82 AKR1C3 (0.96) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL9398455 0.82 AKR1C3 (0.96) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL9398447 0.82 AKR1C3 (0.96) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL11800079 0.82 AKR1C4 (0.67) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4
SCHEMBL11760933 0.82 AKR1C4 (0.67) AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610890-B1 Treatment and/or prevention of diabetic complications; such as 3,3',4,4',5,5'-hexabromo-2,2'-dihydroxy-oxydiphenyl O.N.C.E.-(ORGANIZACION NACIONAL DE CICGOS) (ES) 2003-08-26 US disclosed
US-20030153628-A1 ALDOSE REDUCTASE INHIBITORS AND PHARMACEUTICAL COMPOSITIONS O.N.C.E.-(ORGANIZACION NACIONAL DE CIEGOS) (ES) 2003-08-14 US disclosed
EP-1137621-A1 ALDOSE REDUCTASE INHIBITORS AND PHARMACEUTICAL COMPOSITIONS ORGANIZACION NACIONAL DE CIEGOS ESPANOLES - ONCE - (ES) 2001-10-04 EP disclosed
WO-2000035848-A1 ALDOSE REDUCTASE INHIBITORS AND PHARMACEUTICAL COMPOSITIONS O.N.C.E. - (ORGANIZACION NACIONAL DE CIEGOS) (ES) 2000-06-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030153628-A1 ALDOSE REDUCTASE INHIBITORS AND PHARMACEUTICAL COMPOSITIONS AKR1A1, AKR1B1, AKR1C2 AKR1C4 5/4885AKR1C3 8/4885AKR1C2 3/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.