SCHEMBL8107940

SCHEMBL8107940

COC1(OC)C=CC(CC(C)=O)=CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 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
SCHEMBL3844635 0.69 OPRM1 (0.32)
SCHEMBL16726815 0.65
SCHEMBL15304779 0.62 CYP3A4 (0.35) CYP3A4
SCHEMBL27455373 0.61 NR5A1 (0.33)
SCHEMBL27615096 0.59
SCHEMBL28275890 0.56
SCHEMBL31430625 0.54 CA12 (0.32)
SCHEMBL13942889 0.54
SCHEMBL989411 0.53
SCHEMBL17447344 0.53

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-6156815-A Acid-curable binder systems containing 1,2-disulfones CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-12-05 US disclosed
US-5985950-A Acid-curable binder systems containing 1,2 disulfones CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-11-16 US disclosed
US-5717003-A LATENT ACID CATALYST CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-02-10 US disclosed
US-4980508-A Oxidation of 1,2-disulonyhydrazine compound with concentrated nitric acid MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-12-25 US disclosed