SCHEMBL968939

SCHEMBL968939

[NH]CC1CCc2ccccc2O1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.55
HTR1A P08908 12/20 0.52
SIGMAR1 Q99720 2/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2B P18089 1/20 0.52
ADRA2C P18825 1/20 0.52
HTR1D P28221 10/20 0.49

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
SCHEMBL4936349 0.83 CA2 (0.56) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL4936360 0.83 CA2 (0.56) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL6348788 0.81 HTR1A (0.56) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL5722925 0.81 CA2 (0.55) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL6084492 0.81 CA2 (0.59) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL1568273 0.81 CA2 (0.55) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL1383106 0.81 CA2 (0.59) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL14271049 0.81 CA2 (0.55) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL6051185 0.81 CA2 (0.55) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL936563 0.81 CA2 (0.55) CA2HTR1ASIGMAR1ADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160324823-A1 TREATMENT OF MITOCHONDRIAL DISEASES BIOELECTRON TECHNOLOGY CORPORATION 2016-11-10 US disclosed
US-8791155-B2 Chroman derivatives EDISON PHARMACEUTICALS, INC. (US) 2014-07-29 US disclosed
US-20130267538-A1 TREATMENT OF MITOCHONDRIAL DISEASES GALILEO PHARMACEUTICALS INC. 2013-10-10 US disclosed
US-20120088783-A1 CHROMAN DERIVATIVES AMPERE LIFE SCIENCES, INC. (US) 2012-04-12 US disclosed
US-8044097-B2 Chroman derivatives AMPERE LIFE SCIENCES, INC. (US) 2011-10-25 US disclosed
US-7875607-B2 Neurodegenerative disorders; antiinflammatory agents; antiischemic agents; neuropathic pain; antiepileptic agents; Parkinson's disease; Alzheimer's disease; antidiabetic agents; 3-(6-Hydroxy-2-methyl-3,4,7,8,9,10-hexahydro-7,10-methano-2H -benzo[h]chromen-2-yl)-propionic acid methyl ester AMPERE LIFE SCIENCES, INC. (US) 2011-01-25 US disclosed
US-20090192179-A1 CHROMAN DERIVATIVES EDISON PHARMACEUTICALS, INC. 2009-07-30 US disclosed
US-20090170814-A1 7,8-BICYCLOAKYL-CHROMAN DERIVATIVES EDISON PHARMACEUTICALS, INC. (US) 2009-07-02 US disclosed
US-7514461-B2 Lipoxygenase moderators; autoimmune disease; neurodegenerative disease; respiratory system disorders; cardiovascular disorders; Alzheimer's disease; Parkinson's disease; amyotropic lateral sclerosis EDISON PHARMACEUTICALS, INC. (US) 2009-04-07 US disclosed
US-7470798-B2 Neurodegenerative disorders; antiinflammatory agents; strokes; antiischemic agents; neuropathic pain; brain disorders; antiepileptic agents; Parkinson's disease ; amyotropic lateral sclerosis; Alzheimer's disease; antidiabetic agents EDISON PHARMACEUTICALS, INC. (US) 2008-12-30 US disclosed
US-20050065149-A1 Neurodegenerative disorders; antiinflammatory agents; strokes; antiischemic agents; neuropathic pain; brain disorders; antiepileptic agents; Parkinson's disease ; amyotropic lateral sclerosis; Alzheimer's disease; antidiabetic agents PTC THERAPEUTICS, INC. 2005-03-24 US disclosed
US-20050065150-A1 Lipoxygenase moderators; autoimmune disease; neurodegenerative disease; respiratory system disorders; cardiovascular disorders; Alzheimer's disease; Parkinson's disease; amyotropic lateral sclerosis PTC THERAPEUTICS, INC. 2005-03-24 US disclosed
US-20050065099-A1 Alzheimer's disease; Parkinson's disease; brain disorders; antiepileptic agents; amyotrophic lateral sclerosis; vision defects EDISON PHARMACEUTICALS, INC. 2005-03-24 US disclosed
US-5756521-A Chroman-2-ylmethylamino derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1998-05-26 US disclosed
US-5684039-A Chroman-2-ylmethylamino derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1997-11-04 US disclosed
US-5670667-A DOPAMINE INHIBITORS FOR PSYCHOLOGICAL DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-09-23 US disclosed
US-5663194-A SCHIZOPHRENIA WYETH 1997-09-02 US disclosed
EP-0787037-A1 METHYL IODIDE AS A SOIL FUMIGANT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-08-06 EP disclosed
US-5541199-A DOPAMINE MODULATORS, SCHIZOPHRENIA AMERICAN HOME PRODUCTS CORPORATION (US) 1996-07-30 US disclosed
WO-1996012559-A1 METHYL IODIDE AS A SOIL FUMIGANT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-05-02 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 (8 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-20120088783-A1 CHROMAN DERIVATIVES CYP11B1, CYP11B2, TFAM CA2 2734/4885HTR1A 498/4885SIGMAR1 2374/4885
US-20090192179-A1 CHROMAN DERIVATIVES CYP11B1, CYP11B2, TFAM CA2 2734/4885HTR1A 498/4885SIGMAR1 2374/4885
US-20050065149-A1 Neurodegenerative disorders; antiinflammatory agents; strokes; antiischemic agents; neuropathic pain; brain disorders; antiepileptic agents; Parkinson's disease ; amyotropic lateral sclerosis; Alzheimer's disease; antidiabetic agents NLN, ACAA2, CS CA2 1309/4885HTR1A 833/4885SIGMAR1 1014/4885
US-20050065099-A1 Alzheimer's disease; Parkinson's disease; brain disorders; antiepileptic agents; amyotrophic lateral sclerosis; vision defects CLN6, LDHA, NLN CA2 864/4885HTR1A 928/4885SIGMAR1 3676/4885
US-20160324823-A1 TREATMENT OF MITOCHONDRIAL DISEASES NLN, FH, MFN2 CA2 1183/4885HTR1A 1006/4885SIGMAR1 4004/4885
US-20050065150-A1 Lipoxygenase moderators; autoimmune disease; neurodegenerative disease; respiratory system disorders; cardiovascular disorders; Alzheimer's disease; Parkinson's disease; amyotropic lateral sclerosis ALOX12, ALOX15, ALOX15B CA2 3612/4885HTR1A 429/4885SIGMAR1 3035/4885
US-20130267538-A1 TREATMENT OF MITOCHONDRIAL DISEASES NLN, FH, MFN2 CA2 1183/4885HTR1A 1006/4885SIGMAR1 4004/4885
US-20090170814-A1 7,8-BICYCLOAKYL-CHROMAN DERIVATIVES COQ8A, TFAM, CS CA2 2328/4885HTR1A 765/4885SIGMAR1 2585/4885

“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.