SCHEMBL6648243

SCHEMBL6648243

O=CCCCC1CC(c2ccccc2)=CCN1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.36
HTR2C P28335 1/20 0.35
F2 P00734 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
SCHEMBL9868832 0.81 SIGMAR1 (0.39) SIGMAR1HTR2CF2
SCHEMBL5401265 0.78 SIGMAR1 (0.34) SIGMAR1HTR2CF2
Hydrochloric Acid SCHEMBL6586236 0.78 HTR2C (0.41) SIGMAR1HTR2CF2
SCHEMBL6648602 0.77 SIGMAR1 (0.36) SIGMAR1HTR2CF2
SCHEMBL6648237 0.75 LMNA (0.41) SIGMAR1HTR2CF2
SCHEMBL6368536 0.75 SIGMAR1 (0.34) SIGMAR1HTR2CF2
SCHEMBL5265951 0.74 POLB (0.44) SIGMAR1HTR2C
SCHEMBL9582090 0.73 MCL1 (0.39) HTR2C
SCHEMBL6368137 0.73 LMNA (0.39) SIGMAR1HTR2CF2
SCHEMBL9726241 0.71 ESR1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1469854-A1 CONDENSED HETEROCYCLIC COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-10-27 EP disclosed
WO-2003063874-A1 CONDENSED HETEROCYCLIC COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-08-07 WO disclosed