SCHEMBL875129

SCHEMBL875129

COc1ccccc1N1CCN(CCn2cnc3ccccc3c2=O)CC1

nearest known ligand 0.88

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.88
DRD2 P14416 2/20 0.88
DRD3 P35462 2/20 0.88
HTR7 P34969 3/20 0.71
ADRA1B P35368 3/20 0.68
ADRA1D P25100 1/20 0.58
HTR1B P28222 1/20 0.58
ADRA1A P35348 1/20 0.58

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
SCHEMBL10546291 0.90 HTR1A (0.86) HTR1ADRD2DRD3HTR7ADRA1B
SCHEMBL15105697 0.85 HTR7 (0.70) HTR1ADRD2DRD3HTR7ADRA1B
SCHEMBL10542355 0.84 HTR7 (0.98) HTR1ADRD2DRD3HTR7ADRA1B
SCHEMBL875808 0.84 HTR7 (0.69) HTR1ADRD2DRD3HTR7
SCHEMBL875833 0.83 HTR1A (0.62) HTR1ADRD2DRD3HTR7
SCHEMBL875128 0.81 HTR1A (0.60) HTR1ADRD2DRD3HTR7ADRA1B
SCHEMBL22001855 0.80 DRD2 (0.86) HTR1ADRD2DRD3HTR7
SCHEMBL14761823 0.80 HTR7 (0.79) HTR1ADRD2DRD3HTR7
SCHEMBL14761592 0.79 DRD2 (0.65) HTR1ADRD2DRD3HTR7
SCHEMBL31094938 0.78 DRD2 (0.63) HTR1ADRD2DRD3HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3723759-B1 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER ACHE LABORATORIOS FARMACEUTICOS SA (BR) 2024-01-10 EP claimed
EP-3723759-A2 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER Aché Laboratórios Farmacêuticos S.A. (BR) 2020-10-21 EP claimed
CN-111601600-A Treatment of post-traumatic syndrome disorder 艾奇实验室制药有限公司 2020-08-28 CN claimed
WO-2019113668-A2 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER Aché Laboratórios Farmacêuticos S.A (BR) 2019-06-20 WO claimed
US-9169218-B2 Compounds and pharmaceutical compositions for treating disorders associated with the 5-HT1A and 5-HT2A receptors ACHE LABORATORIOS FARMACEUTICOS S.A. (BR) 2015-10-27 US claimed
EP-2619187-B1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS ACHÉ LABORATÓRIOS FARMAC UTICOS S A (BR) 2015-03-04 EP claimed
US-20140336199-A1 Compounds and Pharmaceutical Compositions for Treating Disorders Associated With the 5-HT1A and 5-HT2A Receptors ACHE LABORATORIOS FARMACEUTICOS S.A., ATC Trustees Abbot Building, 2nd FLoor, Road Town (BR) 2014-11-13 US claimed
US-20140303179-A1 Compounds and Pharmaceutical Compositions for Treating Disorders Associated With the 5-HT1A and 5-HT2A Receptors ACHÉ INTERNATIONAL (BVI) LTD. (VG) 2014-10-09 US claimed
EP-3723759-B1 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER ACHE LABORATORIOS FARMACEUTICOS SA (BR) 2024-01-10 EP disclosed
US-20210338674-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS ACHE LABORATORIOS FARMACEUTICOS SA (BR) 2021-11-04 US disclosed
US-20210221774-A1 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER Aché Laboratórios Farmacêuticos S.A (BR) 2021-07-22 US disclosed
US-20210221774-A1 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER Aché Laboratórios Farmacêuticos S.A (BR) 2021-07-22 US disclosed
US-20210221774-A1 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER Aché Laboratórios Farmacêuticos S.A (BR) 2021-07-22 US disclosed
EP-3723759-A2 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER Aché Laboratórios Farmacêuticos S.A. (BR) 2020-10-21 EP disclosed
US-20140336199-A1 Compounds and Pharmaceutical Compositions for Treating Disorders Associated With the 5-HT1A and 5-HT2A Receptors ACHE LABORATORIOS FARMACEUTICOS S.A., ATC Trustees Abbot Building, 2nd FLoor, Road Town (BR) 2014-11-13 US disclosed
US-20140303179-A1 Compounds and Pharmaceutical Compositions for Treating Disorders Associated With the 5-HT1A and 5-HT2A Receptors ACHÉ INTERNATIONAL (BVI) LTD. (VG) 2014-10-09 US disclosed
US-8735578-B2 Compounds and pharmaceutical compositions for treating disorders associated with the 5-HT1A and 5-HT2A receptors ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A. (BR) 2014-05-27 US disclosed
EP-2619187-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS Aché Laboratórios Farmacêuticos S.A. (BR) 2013-07-31 EP disclosed
US-20130184286-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS ACHÉ INTERNATIONAL (BVI) LTD. (VG) 2013-07-18 US disclosed
WO-2012037634-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A. (BR) 2012-03-29 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-20210338674-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS HTR2A, HTR5A, HTR2C HTR1A 4/4885DRD2 20/4885DRD3 56/4885
US-20140303179-A1 Compounds and Pharmaceutical Compositions for Treating Disorders Associated With the 5-HT1A and 5-HT2A Receptors HTR5A, HTR2A, HTR1A HTR1A 3/4885DRD2 22/4885DRD3 54/4885
US-20140336199-A1 Compounds and Pharmaceutical Compositions for Treating Disorders Associated With the 5-HT1A and 5-HT2A Receptors HTR5A, HTR2A, HTR2C HTR1A 4/4885DRD2 22/4885DRD3 55/4885
US-20130184286-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DISORDERS ASSOCIATED WITH THE 5-HT1A AND 5-HT2A RECEPTORS HTR5A, HTR2A, HTR2C HTR1A 4/4885DRD2 22/4885DRD3 56/4885
US-20210221774-A1 TREATMENT OF POST-TRAUMATIC SYNDROME DISORDER HTR5A, HTR3C, FKBP5 HTR1A 58/4885DRD2 55/4885DRD3 53/4885

“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.