SCHEMBL1138540

SCHEMBL1138540

Cc1ccc(C2CCCCC2O)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 3/20 0.53
AR P10275 3/20 0.43
GRIA4 P48058 1/20 0.41
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL4604753 0.96 SLC18A3 (0.49) SLC18A3ARGRIA4HTR2AHTR2C
SCHEMBL4604755 0.96 SLC18A3 (0.49) SLC18A3ARGRIA4HTR2AHTR2C
SCHEMBL4604751 0.96 SLC18A3 (0.49) SLC18A3ARGRIA4HTR2AHTR2C
SCHEMBL11476408 0.82 SLC18A3 (0.45) SLC18A3GRIA4HTR2AHTR2CHTR2B
SCHEMBL10486574 0.81 ESR2 (0.47) SLC18A3ARCYP3A4CYP2C9
SCHEMBL16883880 0.81 ESR2 (0.47) SLC18A3ARCYP3A4CYP2C9
SCHEMBL5557513 0.79 AR (0.40) SLC18A3ARALDH1A1
SCHEMBL8724940 0.79 KDM1A (0.47) SLC18A3ARGRIA4HTR2CHTR2B
SCHEMBL5562442 0.79 SLC18A3 (0.53) SLC18A3ARGRIA4HTR2AHTR2C
SCHEMBL7995103 0.79 SLC18A3 (0.53) SLC18A3ARCYP1A2CYP2C9

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300886-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2024-09-12 US disclosed
CN-115190815-B Arylcyclohexylamine derivatives and their use in the treatment of psychotic disorders 吉尔伽美什制药公司 2024-06-18 CN disclosed
EP-4358946-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS Gilgamesh Pharmaceuticals, Inc. (US) 2024-05-01 EP disclosed
WO-2022272174-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2022-12-29 WO disclosed
US-20220409555-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS INC (US) 2022-12-29 US disclosed
US-20220409555-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS INC (US) 2022-12-29 US disclosed
EP-4081301-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS Gilgamesh Pharmaceuticals, Inc. (US) 2022-11-02 EP disclosed
CN-115190815-A Arylcyclohexylamine derivatives and their use in the treatment of psychotic disorders 吉尔伽美什制药公司 2022-10-14 CN disclosed
US-11344510-B2 Arylcyclohexylamine derivatives and their use in the treatment of psychiatric disorders GILGAMESH PHARMACEUTICALS, INC. (US) 2022-05-31 US disclosed
US-11344510-B2 Arylcyclohexylamine derivatives and their use in the treatment of psychiatric disorders GILGAMESH PHARMACEUTICALS, INC. (US) 2022-05-31 US disclosed
US-7189850-B2 E.g., 1-phenyl-8-(2-phenyl-cyclohexyl)-1,3,8-triaza-spiro[4.5]decan-4-one; activation of N-methylaspartic acid receptors via Glycine (Gly t-1) inhibition; psychoses; analgesics; neurodegenerative and psychological disorders; schizophrenia; cognition activators; antidepressants; Alzheimer's disease HOFFMANN-LA ROCHE INC. (US) 2007-03-13 US disclosed
US-7189850-B2 E.g., 1-phenyl-8-(2-phenyl-cyclohexyl)-1,3,8-triaza-spiro[4.5]decan-4-one; activation of N-methylaspartic acid receptors via Glycine (Gly t-1) inhibition; psychoses; analgesics; neurodegenerative and psychological disorders; schizophrenia; cognition activators; antidepressants; Alzheimer's disease HOFFMANN-LA ROCHE INC. (US) 2007-03-13 US disclosed
US-7173133-B2 Diaza-spiropiperidine derivatives HOFFMANN-LA ROCHE INC. (US) 2007-02-06 US disclosed
EP-1720873-A1 DIAZA-SPIROPIPERIDINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2006-11-15 EP disclosed
EP-1678177-A1 TRIAZA-SPIROPIPERIDINE DERIVATIVES FOR USE AS GLYT-1 INHIBITORS IN THE TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS F.HOFFMANN-LA ROCHE AG (CH) 2006-07-12 EP disclosed
WO-2005068463-A1 DIAZA-SPIROPIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-07-28 WO disclosed
US-20050154001-A1 Diaza-spiropiperidine derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US disclosed
US-20050107373-A1 E.g., 1-phenyl-8-(2-phenyl-cyclohexyl)-1,3,8-triaza-spiro[4.5]decan-4-one; activation of N-methylaspartic acid receptors via Glycine (Gly t-1) inhibition; psychoses; analgesics; neurodegenerative and psychological disorders; schizophrenia; cognition activators; antidepressants; Alzheimer's disease F. HOFFMANN-LA ROCHE AG (CH) 2005-05-19 US disclosed
WO-2005040166-A1 TRIAZA-SPIROPIPERIDINE DERIVATIVES FOR USE AS GLYT-1 INHIBITORS IN THE TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS F.HOFFMANN-LA ROCHE AG (CH) 2005-05-06 WO disclosed
WO-2005040166-A1 TRIAZA-SPIROPIPERIDINE DERIVATIVES FOR USE AS GLYT-1 INHIBITORS IN THE TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS F.HOFFMANN-LA ROCHE AG (CH) 2005-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240300886-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS HTR2C, PNMT, HTR2A SLC18A3 58/4885AR 1533/4885GRIA4 53/4885
US-11344510-B2 Arylcyclohexylamine derivatives and their use in the treatment of psychiatric disorders HTR2C, PNMT, HTR2A SLC18A3 60/4885AR 1606/4885GRIA4 51/4885
US-20050107373-A1 E.g., 1-phenyl-8-(2-phenyl-cyclohexyl)-1,3,8-triaza-spiro[4.5]decan-4-one; activation of N-methylaspartic acid receptors via Glycine (Gly t-1) inhibition; psychoses; analgesics; neurodegenerative and psychological disorders; schizophrenia; cognition activators; antidepressants; Alzheimer's disease GRIN1, GRIN2A, GRM1 SLC18A3 169/4885AR 1364/4885GRIA4 7/4885
US-20220409555-A1 ARYLCYCLOHEXYLAMINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS HTR2C, PNMT, HTR2A SLC18A3 62/4885AR 2247/4885GRIA4 50/4885
US-20050154001-A1 Diaza-spiropiperidine derivatives HCN3, SCN3A, SLC6A3 SLC18A3 955/4885AR 648/4885GRIA4 359/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.