SCHEMBL30006568

SCHEMBL30006568

O=C(c1cc(Br)ccc1O)c1cc(O)c(O)cc1Br

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.78
HPGD P15428 2/20 0.78
CYP1A2 P05177 1/20 0.78
CYP2C9 P11712 1/20 0.78
CASP1 P29466 1/20 0.78
CYP2C19 P33261 1/20 0.78
GSTA1 P08263 2/20 0.66
CES2 O00748 1/20 0.60
GALR3 O60755 1/20 0.60
SNCA P37840 2/20 0.47
MAPT P10636 5/20 0.45
TMPRSS4 Q9NRS4 1/20 0.44
GAA P10253 3/20 0.44
PTGES O14684 1/20 0.43
AR P10275 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL30004603 1.00 ALOX15 (0.78) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL19519177 1.00 ALOX15 (0.78) ALOX15HPGDCYP1A2CYP2C9CASP1
Benzophenone SCHEMBL19519174 0.89 GSTA1 (0.62) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL15684683 0.88 ALOX15 (1.00) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL19003635 0.84 SNCA (0.50) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL30924439 0.82 ALOX15 (0.66) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL30924440 0.80 CYP1A2 (0.64) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL26441589 0.76 SNCA (0.46) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL29355897 0.76 CES2 (1.00) ALOX15HPGDCYP1A2CYP2C9CASP1
SCHEMBL2156880 0.76 CES2 (1.00) ALOX15HPGDCYP1A2CYP2C9CASP1

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
CN-119241563-B Compound for treating myocardial ischemia reperfusion injury, pharmaceutical composition and application thereof 内蒙古医科大学 2025-03-28 CN disclosed
CN-115212192-B Application of diphenyl ketone derivative in preparation of kidney fibrosis resisting medicine 山西医科大学 2023-09-08 CN disclosed
CN-115212192-A Application of benzophenone derivative in preparation of anti-renal fibrosis medicine 山西医科大学 2022-10-21 CN disclosed