SCHEMBL9532844

SCHEMBL9532844

CCOC(CC1CC(c2ccccc2)=CCN1)OCC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.34
F2 P00734 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL9532708 0.86 NISCH (0.33)
SCHEMBL5265951 0.72 POLB (0.44) SIGMAR1HTR2C
SCHEMBL9868832 0.70 SIGMAR1 (0.39) SIGMAR1F2HTR2C
Hydrochloric Acid SCHEMBL6586236 0.70 HTR2C (0.41) SIGMAR1F2HTR2C
SCHEMBL6648602 0.69 SIGMAR1 (0.36) SIGMAR1F2HTR2C
SCHEMBL10857841 0.68 TUBB4A (0.36) F2HTR2C
SCHEMBL6368536 0.68 SIGMAR1 (0.34) SIGMAR1F2HTR2C
SCHEMBL9175105 0.67 CYP1A2 (0.38) SIGMAR1F2HTR2C
SCHEMBL7808380 0.67 DRD2 (0.48) SIGMAR1HTR2C
SCHEMBL6648243 0.67 SIGMAR1 (0.36) SIGMAR1F2HTR2C

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-0556342-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYOGYSZERKUTATO INTEZET K.V. (HU) 1993-08-25 EP disclosed
WO-1992007854-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYÓGYSZERKUTATÓ INTÉZET KV. (HU) 1992-05-14 WO disclosed