SCHEMBL7290235

SCHEMBL7290235

CN1CCN(C2CC3CC2c2ccccc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCOLN2 Q8IZK6 1/20 0.38
▸ MCOLN1 Q9GZU1 1/20 0.38
▸ HTR2A P28223 2/20 0.37
▸ HTR2C P28335 2/20 0.37
▸ HRH1 P35367 2/20 0.37
▸ SIGMAR1 Q99720 3/20 0.36
▸ CHRNB2 P17787 1/20 0.36
▸ CHRNA4 P43681 1/20 0.36
▸ HTR7 P34969 1/20 0.35

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
SCHEMBL7297531 0.82 TSHR (0.38) —
SCHEMBL7295144 0.74 HTR2A (0.51) HTR2AHTR2CHRH1
Hydrochloric Acid SCHEMBL7338534 0.73 HTR2A (0.50) HTR2AHTR2CHRH1
Water SCHEMBL466846 0.68 SIGMAR1 (0.40) MCOLN2MCOLN1HTR2AHTR2CHRH1
SCHEMBL28325127 0.68 SLC9A3 (0.41) HTR2CHRH1SIGMAR1
SCHEMBL9772314 0.66 ADRA2A (0.41) MCOLN2MCOLN1HTR2AHTR2CHRH1
SCHEMBL7951592 0.66 ADRA2A (0.41) MCOLN2MCOLN1HTR2AHTR2CHRH1
SCHEMBL13503895 0.66 PRCP (0.54) —
SCHEMBL8245892 0.66 HTR2A (0.51) HTR2AHTR2CHRH1HTR7
Water SCHEMBL466845 0.65 HTR2A (0.45) HTR2AHTR2CHRH1

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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