SCHEMBL7450276

SCHEMBL7450276

Cc1ccc(C(c2c(O)cc(CC3(Cc4ccco4)CC3)oc2=O)C2CC2)s1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL7438660 0.87 ALDH1A1 (0.31) ALDH1A1HPGDKMT2A
SCHEMBL7445565 0.86 ALDH1A1 (0.31) ALDH1A1HPGDKMT2A
SCHEMBL7443467 0.85 MAPT (0.33) MAPTLMNATP53ALDH1A1HPGD
SCHEMBL7443227 0.85 LMNA (0.33) MAPTLMNATP53ALDH1A1KMT2A
SCHEMBL7439791 0.84 ALDH1A1 (0.31) ALDH1A1HPGDKMT2A
SCHEMBL7446404 0.84 TP53 (0.33) MAPTTP53ALDH1A1HPGDKMT2A
SCHEMBL7443868 0.83 ALDH1A1 (0.31) ALDH1A1HPGDKMT2A
SCHEMBL7441119 0.83 ALDH1A1 (0.35) MAPTTP53ALDH1A1HPGDKMT2A
SCHEMBL9199590 0.82 MAPT (0.33) MAPTLMNATP53ALDH1A1HPGD
SCHEMBL7445467 0.82 ALDH1A1 (0.30) ALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0668860-B1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES UPJOHN CO (US) 2002-09-11 EP claimed
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 claimed
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 claimed
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
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