SCHEMBL6172935

SCHEMBL6172935

C[Si](C)(C)/C=C/C(C1=C(O)CC2(CCCCCCC2)OC1=O)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL6172876 0.83 KDM4E (0.35) KDM4EHTTATM
SCHEMBL6174513 0.83 KDM4E (0.35) KDM4EHTTATM
SCHEMBL6175848 0.82 KDM4E (0.36) KDM4E
SCHEMBL6176108 0.77 CYP2C9 (0.38) KDM4EHTTATM
SCHEMBL6175498 0.76 LDHA (0.34) HTT
SCHEMBL6174534 0.76 CYP2C9 (0.39)
SCHEMBL6174857 0.70 ALDH1A1 (0.35) KDM4EHTT
SCHEMBL6175404 0.69 SMN1; SMN2 (0.36) HTT
SCHEMBL6175954 0.67 HSD11B1 (0.48)
SCHEMBL6604874 0.67 LDHA (0.42) KDM4EHTT

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
EP-1203770-B1 Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases UPJOHN CO (US) 2005-03-09 EP disclosed
EP-1203770-A1 Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating hyperplasia and other diseases PHARMACIA & UPJOHN COMPANY (US) 2002-05-08 EP disclosed
EP-0668860-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES PHARMACIA & UPJOHN COMPANY (US) 1995-08-30 EP disclosed
WO-1994011361-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES THE UPJOHN COMPANY (US) 1994-05-26 WO disclosed