SCHEMBL8868873

SCHEMBL8868873

CC1(C)CCC2(CC1)CC(=O)OC2=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 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
SCHEMBL16043323 0.88 LMNA (0.31) LMNACYP2C9
SCHEMBL347199 0.79
SCHEMBL595648 0.77
SCHEMBL6525946 0.77 TP53 (0.32) LMNAMAPTKDM4E
SCHEMBL5846168 0.76 TSHR (0.40)
SCHEMBL21582317 0.76 GAA (0.32) KDM4E
SCHEMBL11469410 0.74
Hydrochloric Acid SCHEMBL21582402 0.74 CHRM2 (0.42)
SCHEMBL12558322 0.70
SCHEMBL237697 0.69

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
US-5654323-A 2-NITROGEN-CONTAINING FUNCTIONAL GROUP-HALOBENZOTHIAZOLES; ANALGESICS; ANTIINFLAMMATORY AND HYPOTENSIVE AGENTS; INHIBITORS OF CYTOKINES (INCLUDING TUMOR NECROSIS FACTOR) AND PHOSPHOLIPASE; SEPTIC SHOCK ADIR ET COMPAGNIE (FR) 1997-08-05 US disclosed
US-5597819-A ANTIINFLAMMATORY AGENTS ADIR ET COMPAGNIE (FR) 1997-01-28 US disclosed
US-5550143-A Heterocyclic compounds ADIR ET COMPAGNIE (FR) 1996-08-27 US disclosed
EP-0572308-A2 Heterocyclic derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-12-01 EP disclosed