SCHEMBL11062183

SCHEMBL11062183

Cc1cc2c(cc1N1CC(C)C(C)C1)OC(=O)C2C

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 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
SCHEMBL11062182 1.00 MEN1 (0.32) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11065581 1.00 MEN1 (0.32) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11065574 1.00 MEN1 (0.32) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11059053 0.85 GAA (0.30)
SCHEMBL11058233 0.85 ALDH1A1 (0.42) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11064477 0.84 ALDH1A1 (0.41) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11059398 0.84 ALDH1A1 (0.41) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11064662 0.83 PDE3B (0.40) ALDH1A1MAPT
SCHEMBL7778971 0.81 GAA (0.34) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11044418 0.78 GAA (0.31)

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-0078241-A2 Furanes CIBA-GEIGY AG (CH) 1983-05-04 EP claimed
US-4451462-A Method of treating inflammation and pain using heteramino benzofurans CIBA-GEIGY CORPORATION (US) 1984-05-29 US disclosed
US-4426380-A ANTIINFLAMMATORY, ANALGESIC, SUNSCREEN CIBA-GEIGY CORPORATION (US) 1984-01-17 US disclosed
EP-0078241-A2 Furanes CIBA-GEIGY AG (CH) 1983-05-04 EP disclosed