SCHEMBL6801671

SCHEMBL6801671

C1=CC=C(C2CCCCC2)NC=C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.30

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
SCHEMBL28136032 1.00 KMO (0.30) KMO
SCHEMBL27772571 1.00 KMO (0.30) KMO
SCHEMBL27372160 1.00 KMO (0.30) KMO
SCHEMBL27901965 1.00 KMO (0.30) KMO
SCHEMBL28162041 1.00 KMO (0.30) KMO
SCHEMBL28004794 1.00 KMO (0.30) KMO
SCHEMBL27655190 0.98
SCHEMBL11554314 0.98
SCHEMBL27783997 0.96
SCHEMBL28226834 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020169156-A1 Azacyclooctane and heptane derivatives, their preparation and use in therapy NEUROSEARCH A/S 2002-11-14 US claimed
WO-2022228547-A1 PHOSPHONYL DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 2022-11-03 WO disclosed
WO-2022111526-A1 BENZENE RING DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 四川海思科制药有限公司 2022-06-02 WO disclosed
CN-109867661-A Adjust the amides compound and application thereof of WNT signal path 中国医学科学院药物研究所 2019-06-11 CN disclosed
CN-101511805-B As dopamine D3Novel carbonylated (aza) cyclohexanes with receptor ligands BIOPROJET SOC CIV 2013-10-30 CN disclosed
CN-102076214-A Gastrin releasing peptide compounds BRACCO IMAGING SPA 2011-05-25 CN disclosed
CN-101511805-A As dopamine D3Novel carbonylated (aza) cyclohexanes with receptor ligands BIOPROJET SOC CIV (FR) 2009-08-19 CN disclosed
US-6680314-B2 USEFUL FOR THE TREATMENT OF DISEASES INVOLVING THE CHOLINERGIC SYSTEM OF THE CENTRAL NERVOUS SYSTEM, PAIN, INFLAMMATORY DISEASES, DISEASES CAUSED BY SMOOTH MUSCLE CONTRACTIONS, LEARNING DEFICIT, COGNITION DEFICIT, ATTENTION DEFICIT NEUROSEARCH A/S (DK) 2004-01-20 US disclosed
EP-0984943-B1 AZACYCLOOCTANE AND HEPTANE DERIVATIVES, THEIR PREPARATION AND USEIN THERAPY NEUROSEARCH AS (DK) 2002-12-11 EP disclosed
US-20020169156-A1 Azacyclooctane and heptane derivatives, their preparation and use in therapy NEUROSEARCH A/S 2002-11-14 US disclosed
US-6420395-B1 DISORDERS OR DISEASES INVOLVING THE CHOLINERGIC SYSTEM OF THE CENTRAL NERVOUS SYSTEM, PAIN, INFLAMMATORY DISEASES, DISEASES CAUSED BY SMOOTH MUSCLE CONTRACTIONS AND AS ASSISTANCE IN THE CESSATION OF CHEMICAL SUBSTANCE ABUSE. NEUROSEARCH A/S (DK) 2002-07-16 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 (1 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-20020169156-A1 Azacyclooctane and heptane derivatives, their preparation and use in therapy CHRNA1, CHRNB1, CHRNA3 KMO 603/4885

“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.