SCHEMBL9040756

SCHEMBL9040756

CN1Cc2ccc(O)cc2C12CCCc1ccccc12

nearest known ligand 0.90

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 7/20 0.48
DRD5 P21918 7/20 0.48
DRD2 P14416 6/20 0.48
DRD3 P35462 6/20 0.48
DRD4 P21917 5/20 0.48

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
SCHEMBL9038214 0.96 DRD1 (0.47) DRD1DRD5DRD2DRD3DRD4
SCHEMBL9037928 0.89 KDM1A (0.46)
SCHEMBL9040970 0.84 SIGMAR1 (0.46)
SCHEMBL9041165 0.82 DRD1 (0.50) DRD1DRD5DRD2DRD3DRD4
SCHEMBL9038313 0.79 MAPK1 (0.42)
SCHEMBL9040302 0.78 DRD1 (0.49) DRD1DRD5DRD2DRD3DRD4
SCHEMBL9037683 0.73 SIGMAR1 (0.49)
SCHEMBL9040061 0.69 SIGMAR1 (0.50)
SCHEMBL6711237 0.68 ALDH1A1 (0.46)
SCHEMBL15053396 0.67 SIGMAR1 (0.51) DRD1DRD5DRD2DRD3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0441598-B1 Spiroisoindole compounds ZENECA INC (US) 1996-09-04 EP disclosed
EP-0535192-B1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME HOFFMANN LA ROCHE (CH) 1996-06-19 EP disclosed
US-5486466-A ENZYME INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1996-01-23 US disclosed
US-5399741-A DNA gyrase inhibitors, process for their manufacture and pharmaceutical preparations containing same HOFFMANN-LA ROCHE INC. (US) 1995-03-21 US disclosed
US-5294609-A Microbiocides HOFFMANN-LAROCHE INC. (US) 1994-03-15 US disclosed
EP-0535192-A1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME. HOFFMANN LA ROCHE (CH) 1993-04-07 EP disclosed
WO-1992018490-A1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME F. HOFFMANN-LA ROCHE AG (CH) 1992-10-29 WO disclosed
US-5098925-A Neurological disorders in mammals ICI AMERICAS INC. (US) 1992-03-24 US disclosed
EP-0441598-A2 Spiroisoindole compounds ZENECA INC. (US) 1991-08-14 EP disclosed