SCHEMBL265887

SCHEMBL265887

COc1cccc2c1C(N)CC2

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.58
DRD2 P14416 3/20 0.57
DRD3 P35462 1/20 0.57
HTR1A P08908 10/20 0.49
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
CHRM3 P20309 1/20 0.47

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
SCHEMBL26962405 1.00 ACHE (0.58) ACHEDRD2DRD3HTR1ACHRM2
SCHEMBL30563633 1.00 ACHE (0.58) ACHEDRD2DRD3HTR1ACHRM2
SCHEMBL598626 1.00 ACHE (0.58) ACHEDRD2DRD3HTR1ACHRM2
Hydrochloric Acid SCHEMBL659578 0.98 ACHE (0.61) ACHEDRD2DRD3HTR1ACHRM2
Hydrochloric Acid SCHEMBL31186909 0.98 ACHE (0.61) ACHEDRD2DRD3HTR1ACHRM2
Hydrochloric Acid SCHEMBL30563614 0.98 ACHE (0.61) ACHEDRD2DRD3HTR1ACHRM2
Hydrochloric Acid SCHEMBL26962688 0.98 ACHE (0.61) ACHEDRD2DRD3HTR1ACHRM2
SCHEMBL266635 0.90 DRD2 (0.50) ACHEDRD2DRD3HTR1A
SCHEMBL8666712 0.81 DRD2 (0.57) DRD2DRD3HTR1ACHRM2CHRM1
Hydrochloric Acid SCHEMBL8670289 0.80 DRD2 (0.56) DRD2DRD3HTR1ACHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA AFRAXIS HOLDINGS INC (US) 2014-12-11 US disclosed
US-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA AFRAXIS HOLDINGS INC (US) 2014-12-11 US disclosed
US-8674095-B2 Compounds for treating neuropsychiatric conditions AFRAXIS HOLDINGS, INC. (US) 2014-03-18 US disclosed
US-8674095-B2 Compounds for treating neuropsychiatric conditions AFRAXIS HOLDINGS, INC. (US) 2014-03-18 US disclosed
US-8431378-B2 Aminotransferase, gene encoding the same, and methods of using them KANEKA CORPORATION (JP) 2013-04-30 US disclosed
US-20130096115-A1 METHODS FOR TREATING AUTISM AFRAXIS, INC. (US) 2013-04-18 US disclosed
US-20130096115-A1 METHODS FOR TREATING AUTISM AFRAXIS, INC. (US) 2013-04-18 US disclosed
US-20130059824-A1 METHODS FOR TREATING MILD COGNITIVE IMPAIRMENT AFRAXIS, INC. (US) 2013-03-07 US disclosed
US-20130059824-A1 METHODS FOR TREATING MILD COGNITIVE IMPAIRMENT AFRAXIS, INC. (US) 2013-03-07 US disclosed
EP-2328880-B1 6-SUBSTITUTED BENZOXAZINES AS 5-HT-5A RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2012-10-31 EP disclosed
WO-2008068157-A1 2-AMINOQUINOLINES AS 5-HT(5A) RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2008-06-12 WO disclosed
EP-1889907-A1 NOVEL AMINO GROUP TRANSFERASE, GENE ENCODING THE SAME AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2008-02-20 EP disclosed
EP-1535902-B1 Aminoindan derivatives TEVA PHARMA (IL) 2007-11-07 EP disclosed
US-RE39616-E1 Aminoindan derivatives TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2007-05-08 US disclosed
EP-1535902-A1 Aminoindan derivatives TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2005-06-01 EP disclosed
EP-0966435-B1 AMINOINDAN DERIVATIVES TEVA PHARMA (IL) 2005-04-06 EP disclosed
US-6538025-B2 Aminoindan derivatives TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2003-03-25 US disclosed
US-20020188020-A1 Aminoindan derivatives YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM 2002-12-12 US disclosed
US-6462222-B1 TREATMENT OF DEMENTIAS OF THE ALZHEIMER TYPE AND MEMORY DISORDERS AS WELL AS ATTENTION DEFECIT DISORDERS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2002-10-08 US disclosed
US-6303650-B1 FOR THERAPY OF ALZHEIMER'S DISEASE OR DEMENTIA YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2001-10-16 US 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 (4 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-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA GRIN2A, GRIN2C, GRIN3A ACHE 953/4885DRD2 2088/4885DRD3 2825/4885
US-20130096115-A1 METHODS FOR TREATING AUTISM PAK2, PAK3, PAK4 ACHE 479/4885DRD2 3950/4885DRD3 4031/4885
US-20020188020-A1 Aminoindan derivatives SNCA, HTR1A, HTR1D ACHE 58/4885DRD2 18/4885DRD3 9/4885
US-20130059824-A1 METHODS FOR TREATING MILD COGNITIVE IMPAIRMENT CHAT, PSEN2, PAK2 ACHE 59/4885DRD2 3792/4885DRD3 4009/4885

“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.