SCHEMBL11044928

SCHEMBL11044928

O=C(O)C(Br)=Cc1cccc(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
CCNB2 O95067 1/20 0.46
CDK1 P06493 1/20 0.46
CDK4 P11802 1/20 0.46
CCNB1 P14635 1/20 0.46
CCND1 P24385 1/20 0.46
CCNB3 Q8WWL7 1/20 0.46
LCK P06239 2/20 0.46
GFER P55789 1/20 0.45
MMP1 P03956 2/20 0.44
MMP2 P08253 2/20 0.44
MMP9 P14780 2/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA6 P23280 1/20 0.42
CA9 Q16790 1/20 0.42
FBP1 P09467 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL11044925 1.00 KDM4E (0.58) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL1137220 0.81 AKR1C3 (0.66) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL1137218 0.81 AKR1C3 (0.66) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL16029355 0.81 KDM4E (0.62) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL30513704 0.81 KDM4E (0.62) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL16029354 0.81 KDM4E (0.62) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL16029353 0.81 KDM4E (0.62) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL6381221 0.81 KDM4E (0.62) KDM4ECCNB2CDK1CDK4CCNB1
SCHEMBL1804114 0.80 AKR1C3 (0.61) KDM4EFBP1MEN1KMT2AAKR1C3
SCHEMBL1804115 0.80 AKR1C3 (0.61) KDM4EFBP1MEN1KMT2AAKR1C3

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
EP-0028063-B1 PHENOL DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 1984-06-13 EP disclosed
EP-0028063-A1 Phenol derivatives, processes for their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1981-05-06 EP disclosed