SCHEMBL7278577

SCHEMBL7278577

O=C(NC1CN2CCC1CC2)c1cccc(Cl)c1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 10/20 0.71
HTR3A P46098 3/20 0.71
HTR3E A5X5Y0 2/20 0.71
HTR3B O95264 2/20 0.71
HTR3D Q70Z44 2/20 0.71
HTR3C Q8WXA8 2/20 0.71
TSHR P16473 2/20 0.71
ALOX15 P16050 1/20 0.71
RXFP1 Q9HBX9 1/20 0.57

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
SCHEMBL7293857 1.00 CHRNA7 (0.71) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL7290441 1.00 CHRNA7 (0.71) CHRNA7HTR3AHTR3EHTR3BHTR3D
Hydrochloric Acid SCHEMBL7288130 0.99 CHRNA7 (0.70) CHRNA7HTR3AHTR3EHTR3BHTR3D
Hydrochloric Acid SCHEMBL10342498 0.99 CHRNA7 (0.70) CHRNA7HTR3AHTR3EHTR3BHTR3D
Hydrochloric Acid SCHEMBL9183102 0.99 CHRNA7 (0.70) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6682650 0.94 CHRNA7 (0.62) CHRNA7HTR3AHTR3EHTR3BHTR3D
Cadaverine Tartrate SCHEMBL9480676 0.93 CHRNA7 (0.62) CHRNA7HTR3AHTR3EHTR3BHTR3D
Cadaverine Tartrate SCHEMBL9480682 0.93 CHRNA7 (0.62) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL7287511 0.93 CHRNA7 (0.62) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4198789 0.87 CHRNA7 (0.64) CHRNA7HTR3AHTR3EHTR3BHTR3D

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021127642-A1 SELECTIVE VALORIZATION OF BIOMASS SUGARS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-06-24 WO claimed
US-11618763-B2 Selective valorization of biomass sugars MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-04-04 US disclosed
US-20210188890-A1 SELECTIVE VALORIZATION OF BIOMASS SUGARS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2021-06-24 US disclosed
WO-2021127642-A1 SELECTIVE VALORIZATION OF BIOMASS SUGARS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-06-24 WO disclosed
EP-0546181-B1 INDOLE DERIVATIVES AND THEIR USE AS SEROTONIN ANTAGONISTS NIPPON SHINYAKU CO LTD (JP) 1995-08-02 EP disclosed
US-5342845-A Useful as a gastrointestinal motor activity regulator, antimigraine, antipsychotic or antianxiety drug NIPPON SHINYAKU COMPANY LIMITED (JP) 1994-08-30 US disclosed
US-5237066-A Reacting quinuclidone with (R)-alpha-methylbenzylamine; reduction with alkali metal borohydride; hydrogenolysis in acid DELANDE S.A. (FR) 1993-08-17 US disclosed
EP-0546181-A1 INDOLE DERIVATIVES AND THEIR USE AS SEROTONIN ANTAGONISTS NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-06-16 EP disclosed
US-5206246-A Anxiolytic agents A. H. ROBINS COMPANY, INCORPORATED (US) 1993-04-27 US disclosed
EP-0353372-B1 Antischizophrenic-S-N-(1-azabicyclo[2.2.2.]oct-3-yl) benzamides and thiobenzamides SYNTHELABO (FR) 1993-02-03 EP disclosed
US-5025022-A Method of treating or preventing schizophrenia and/or psychosis using S-N-(1-azabicyclo[2.2.2]oct-3-yl)benzamides and thiobenzamides A.H. ROBINS COMPANY, INCORPORATED A VA CORPORATION 1991-06-18 US disclosed
US-5017580-A Memory enhancing-R-N-(1-azabicyclo[2.2.2.]oct-3-yl)benzamides and thiobenzamides A.H. ROBINS COMPANY, INCORPORATED A VA CORPORATION 1991-05-21 US disclosed
EP-0353372-A1 Antischizophrenic-S-N-(1-azabicyclo[2.2.2.]oct-3-yl) benzamides and thiobenzamides SYNTHELABO (FR) 1990-02-07 EP disclosed
EP-0353371-A1 Memory enhancing-R-N-(1-azabicyclo[2.2.2] oct-3-yl) benzamides and thiobenzamides SYNTHELABO (FR) 1990-02-07 EP disclosed
EP-0311724-A1 Anxiolytic-R-N-(1-azabicyclo[2.2.2]oct-3-yl) benzamides and thiobenzamides SYNTHELABO (FR) 1989-04-19 EP 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 (2 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-11618763-B2 Selective valorization of biomass sugars GALE, FBP1, GNE CHRNA7 3850/4885HTR3A 4081/4885HTR3E 4467/4885
US-20210188890-A1 SELECTIVE VALORIZATION OF BIOMASS SUGARS GALE, FBP1, GNE CHRNA7 3850/4885HTR3A 4081/4885HTR3E 4467/4885

“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.