SCHEMBL14464474

SCHEMBL14464474

COc1ccc2oc(=O)c(C(=O)c3cc4cc(Cl)ccc4oc3=O)cc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.73
▸ MEN1 O00255 1/20 0.73
▸ KDM4E B2RXH2 7/20 0.69
▸ ALDH1A1 P00352 5/20 0.69
▸ HPGD P15428 2/20 0.69
▸ CA1 P00915 2/20 0.69
▸ CA2 P00918 2/20 0.69
▸ CA12 O43570 1/20 0.69
▸ CA3 P07451 1/20 0.69
▸ CA6 P23280 1/20 0.69
▸ CA5A P35218 1/20 0.69
▸ CA7 P43166 1/20 0.69
▸ CA9 Q16790 1/20 0.69
▸ CA14 Q9ULX7 1/20 0.69
▸ CA5B Q9Y2D0 1/20 0.69
▸ MAOB P27338 9/20 0.69
▸ GAA P10253 2/20 0.64
▸ CYP1A2 P05177 1/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ GPR35 Q9HC97 1/20 0.62

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
SCHEMBL2032914 0.92 KDM4E (0.81) KMT2AKDM4EALDH1A1HPGDCA1
SCHEMBL1366856 0.87 KDM4E (0.79) KMT2AMEN1KDM4EALDH1A1CA1
SCHEMBL13857249 0.82 MAOB (0.69) KMT2AMEN1KDM4EALDH1A1CA1
SCHEMBL4346175 0.82 MEN1 (0.67) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL1366464 0.82 MEN1 (0.67) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL1366462 0.82 MEN1 (0.67) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL978456 0.82 KDM4E (1.00) KMT2AKDM4EALDH1A1HPGDCA1
SCHEMBL29963204 0.82 KDM4E (1.00) KMT2AKDM4EALDH1A1HPGDCA1
SCHEMBL7527810 0.82 ALDH1A1 (1.00) KMT2AKDM4EALDH1A1HPGDCA1
SCHEMBL1366572 0.82 KMT2A (0.69) KMT2AMEN1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007082178-A2 PROSTAGLANDIN REDUCTASE INHIBITORS ABGENOMICS CORPORATION (TW) 2007-07-19 — — WO disclosed
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