SCHEMBL6362093

SCHEMBL6362093

CCCNC(=O)c1cc(Cl)ccc1OC

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.78
▸ DNMT3A Q9Y6K1 1/20 0.68
▸ POLB P06746 1/20 0.64
▸ THRB P10828 1/20 0.64
▸ RECQL P46063 1/20 0.64
▸ TDP1 Q9NUW8 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ ALDH1A1 P00352 2/20 0.63
▸ HDAC1 Q13547 2/20 0.62
▸ HDAC6 Q9UBN7 2/20 0.62
▸ NLRP3 Q96P20 3/20 0.61
▸ GAA P10253 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ DRD2 P14416 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
SCHEMBL9122129 0.88 LMNA (0.74) LMNADNMT3APOLBALDH1A1HDAC1
SCHEMBL13753903 0.88 LMNA (1.00) LMNADNMT3ARECQLALDH1A1HDAC1
Hydrochloric Acid SCHEMBL9585195 0.86 LMNA (0.70) LMNADNMT3AALDH1A1HDAC1HDAC6
SCHEMBL31743129 0.85 LMNA (0.68) LMNADNMT3AALDH1A1HDAC1HDAC6
SCHEMBL18029599 0.84 DNMT3A (0.82) LMNADNMT3AHDAC1HDAC6NLRP3
SCHEMBL11707875 0.84 LMNA (0.76) LMNADNMT3ARECQLL3MBTL1ALDH1A1
SCHEMBL3784241 0.82 DNMT3A (0.80) LMNADNMT3AHDAC1HDAC6NLRP3
SCHEMBL8261934 0.82 DNMT3A (0.84) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL16261151 0.82 LMNA (0.61) LMNADNMT3AALDH1A1HDAC1HDAC6
SCHEMBL16261149 0.81 LMNA (0.72) LMNADNMT3APOLBL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168654-B2 Quinuclidine derivatives binding to mucarinic M3 receptors NOVARTIS AG (CH) 2012-05-01 — — US disclosed
US-8168654-B2 Quinuclidine derivatives binding to mucarinic M3 receptors NOVARTIS AG (CH) 2012-05-01 — — US disclosed
US-20100041887-A1 QUINUCLIDINE DERIVATIVES BINDING TO MUCARINIC M3 RECEPTORS COLLINGWOOD STEPHEN PAUL 2010-02-18 — — US disclosed
US-20100041887-A1 QUINUCLIDINE DERIVATIVES BINDING TO MUCARINIC M3 RECEPTORS COLLINGWOOD STEPHEN PAUL 2010-02-18 — — US disclosed
US-20070060563-A1 Quinuclidine derivatives binding to mucarinic m3 receptors NOVARTIS AG (CH) 2007-03-15 — — US disclosed
US-20070060563-A1 Quinuclidine derivatives binding to mucarinic m3 receptors NOVARTIS AG (CH) 2007-03-15 — — 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 (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-20070060563-A1 Quinuclidine derivatives binding to mucarinic m3 receptors CHRM3, CHRM2, CHRM1 LMNA 3433/4885DNMT3A 3781/4885POLB 4046/4885
US-20100041887-A1 QUINUCLIDINE DERIVATIVES BINDING TO MUCARINIC M3 RECEPTORS CHRM3, CHRM2, CHRM1 LMNA 3433/4885DNMT3A 3781/4885POLB 4046/4885

“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.

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