SCHEMBL7295144

SCHEMBL7295144

CN1CCN(CC2CC3CC2c2ccccc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 4/20 0.51
▸ HTR2C P28335 3/20 0.51
▸ HRH1 P35367 3/20 0.51
▸ ACHE P22303 1/20 0.43
▸ DRD2 P14416 13/20 0.42
▸ DRD4 P21917 11/20 0.42
▸ MC4R P32245 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39

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
Hydrochloric Acid SCHEMBL7338534 0.98 HTR2A (0.50) HTR2AHTR2CHRH1ACHEDRD2
Water SCHEMBL466845 0.87 HTR2A (0.45) HTR2AHTR2CHRH1ACHEDRD2
SCHEMBL7290101 0.84 SLC6A4 (0.46) HTR2AHTR2CHRH1DRD2DRD4
SCHEMBL22335162 0.76 DRD2 (0.69) DRD2DRD4
SCHEMBL19262539 0.76 DRD2 (0.69) DRD2DRD4
SCHEMBL7290235 0.74 MCOLN2 (0.38) HTR2AHTR2CHRH1
SCHEMBL9442839 0.73 HTR2C (0.41) HTR2AHTR2C
SCHEMBL11805096 0.70 HTR2C (0.59) HTR2AHTR2C
SCHEMBL11226929 0.69 SLC6A4 (0.59) HTR2AHTR2CHRH1DRD2
SCHEMBL9442852 0.69 OPRM1 (0.42) HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0455195-B1 Ethanobicyclic amine derivatives for CNS disorders SEARLE & CO (US) 1997-10-22 — — EP claimed
US-5215992-A Treating psychotic, convulsive, dystonic disorders, cerebral ischemia G. D. SEARLE & CO. (US) 1993-06-01 — — US claimed
EP-0455195-A2 Ethanobicyclic amine derivatives for CNS disorders G.D. Searle & Co. (US) 1991-11-06 — — EP claimed
EP-0455195-B1 Ethanobicyclic amine derivatives for CNS disorders SEARLE & CO (US) 1997-10-22 — — EP disclosed
US-5215992-A Treating psychotic, convulsive, dystonic disorders, cerebral ischemia G. D. SEARLE & CO. (US) 1993-06-01 — — US disclosed
US-5089506-A Antipsychotic agents, anticonvulsants G. D. SEARLE & CO. (US) 1992-02-18 — — US disclosed
EP-0455195-A2 Ethanobicyclic amine derivatives for CNS disorders G.D. Searle & Co. (US) 1991-11-06 — — EP disclosed
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