SCHEMBL905203

SCHEMBL905203

Clc1cncc(OC[C@@H]2CCCN2)c1

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNA3 P32297 5/20 0.71
CHRNB4 P30926 3/20 0.71
CHRNB2 P17787 9/20 0.63
CHRNA4 P43681 9/20 0.63
AKT1 P31749 1/20 0.60
CHRNA1 P02708 1/20 0.59
CHRNG P07510 1/20 0.59
CHRNB1 P11230 1/20 0.59
CHRND Q07001 1/20 0.59
LTA4H P09960 1/20 0.58
CHRNA2 Q15822 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
SCHEMBL905216 1.00 CHRNA3 (0.71) CHRNA3CHRNB4CHRNB2CHRNA4AKT1
SCHEMBL3223507 1.00 CHRNA3 (0.71) CHRNA3CHRNB4CHRNB2CHRNA4AKT1
Hydrochloric Acid SCHEMBL7839142 0.99 CHRNA3 (0.69) CHRNA3CHRNB4CHRNB2CHRNA4AKT1
Hydrochloric Acid SCHEMBL7373497 0.99 CHRNA3 (0.69) CHRNA3CHRNB4CHRNB2CHRNA4AKT1
SCHEMBL3224827 0.90 CHRNB2 (0.68) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA2
SCHEMBL2437117 0.90 CHRNB2 (0.68) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA2
Hydrochloric Acid SCHEMBL7408459 0.88 CHRNB2 (0.67) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA2
SCHEMBL6588519 0.84 CHRNB2 (0.64) CHRNA3CHRNB4CHRNB2CHRNA4AKT1
SCHEMBL6583246 0.84 CHRNB2 (0.64) CHRNA3CHRNB4CHRNB2CHRNA4AKT1
Hydrochloric Acid SCHEMBL6584098 0.83 CHRNB2 (0.62) CHRNA3CHRNB4CHRNB2CHRNA4AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663912-B1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LAB (US) 2001-12-12 EP claimed
US-5948793-A 3-pyridyloxymethyl heterocyclic ether compounds useful in controlling neurotransmitter release ABBOTT LABORATORIES (US) 1999-09-07 US claimed
EP-0663912-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1995-07-26 EP claimed
EP-0663912-A4 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION. ABBOTT LAB (US) 1995-02-17 EP claimed
WO-1994008992-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1994-04-28 WO claimed
US-20180092916-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE UNIVERSITY OF SOUTH FLORIDA (US) 2018-04-05 US disclosed
US-9782404-B2 Methods of treating disease-induced ataxia and non-ataxic imbalance UNIVERSITY OF SOUTH FLORIDA (US) 2017-10-10 US disclosed
US-9463190-B2 Methods of treating disease-induced ataxia and non-ataxic imbalance UNIVERSITY OF SOUTH FLORIDA (US) 2016-10-11 US disclosed
US-20140371208-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE UNIVERSITY OF SOUTH FLORIDA 2014-12-18 US disclosed
US-20110237597-A1 METHOD OF TREATING PERIPHERAL NERVE SENSORY LOSS USING COMPOUNDS HAVING NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY UNIVERSITY OF SOUTH FLORIDA 2011-09-29 US disclosed
US-20110059905-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE UNIVERSITY OF SOUTH FLORIDA 2011-03-10 US disclosed
EP-2271344-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE University of South Florida (US) 2011-01-12 EP disclosed
CN-101568258-A Pyridine derivatives for combating pests BASF SE (DE) 2009-10-28 CN disclosed
EP-2086325-A1 PYRIDINE COMPOUNDS FOR COMBATING PESTS BASF SE (DE) 2009-08-12 EP disclosed
WO-2008065145-A1 PYRIDINE COMPOUNDS FOR COMBATING PESTS BASF SE (DE) 2008-06-05 WO disclosed
EP-0663912-B1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LAB (US) 2001-12-12 EP disclosed
US-5948793-A 3-pyridyloxymethyl heterocyclic ether compounds useful in controlling neurotransmitter release ABBOTT LABORATORIES (US) 1999-09-07 US disclosed
EP-0663912-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1995-07-26 EP disclosed
EP-0663912-A4 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION. ABBOTT LAB (US) 1995-02-17 EP disclosed
WO-1994008992-A1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LABORATORIES (US) 1994-04-28 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 (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-20140371208-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE CHRNA6, CHRNA7, CHRNA2 CHRNA3 6/4885CHRNB4 10/4885CHRNB2 9/4885
US-20110059905-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE CHRNA6, CHRNA7, CHRNA2 CHRNA3 6/4885CHRNB4 10/4885CHRNB2 9/4885
US-20180092916-A1 METHODS OF TREATING DISEASE-INDUCED ATAXIA AND NON-ATAXIC IMBALANCE CHRNA6, CHRNA7, CHRNA2 CHRNA3 6/4885CHRNB4 10/4885CHRNB2 9/4885
US-20110237597-A1 METHOD OF TREATING PERIPHERAL NERVE SENSORY LOSS USING COMPOUNDS HAVING NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY ACHE, CHRNA6, CHRNB2 CHRNA3 13/4885CHRNB4 7/4885CHRNB2 3/4885

“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.