SCHEMBL6239506

SCHEMBL6239506

CCOP(=O)(O)C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 3/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.40
CXCL12 P48061 1/20 0.39

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
SCHEMBL6235933 0.83 POLB (0.48) KMT2ALMNACA12CA1CA2
SCHEMBL6237835 0.82 POLB (0.59) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL1832869 0.74 KDM4E (0.52) ALDH1A1KMT2AKDM4ELMNACA12
SCHEMBL23357559 0.73 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4ELMNACA12
SCHEMBL777805 0.73 ACP3 (0.57) CA12
SCHEMBL12229756 0.73 ALDH1A1 (0.49) ALDH1A1KMT2AKDM4ELMNACA12
SCHEMBL1835121 0.72 KDM4E (0.51) ALDH1A1KMT2AKDM4ELMNACA12
SCHEMBL779299 0.72 ALDH1A1 (0.47) ALDH1A1KMT2AKDM4ELMNACA12
SCHEMBL894078 0.71 ALDH1A1 (0.44) ALDH1A1KMT2AKDM4ELMNAGAA
SCHEMBL11249732 0.71 LMNA (0.51) ALDH1A1KMT2AKDM4ELMNACA12

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-2005003143-A1 NOVEL POTASSIUM CHANNEL MODULATORS POSEIDON PHARMACEUTICALS A/S (DK) 2005-01-13 WO claimed
WO-2005003143-A1 NOVEL POTASSIUM CHANNEL MODULATORS POSEIDON PHARMACEUTICALS A/S (DK) 2005-01-13 WO disclosed