SCHEMBL6358792

SCHEMBL6358792

CCCCNC(=O)Nc1ccc(CCCC)cc1C

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
POLB P06746 1/20 0.52
MEN1 O00255 1/20 0.50
MAPT P10636 4/20 0.48
ALDH1A1 P00352 2/20 0.48
EPHX2 P34913 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
CNR1 P21554 1/20 0.46
S1PR1 P21453 1/20 0.46
SKP2 Q13309 1/20 0.45
LMNA P02545 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL29715987 0.82 ESR1 (0.51) KMT2APOLBMEN1MAPTALDH1A1
SCHEMBL4393968 0.82 ESR1 (0.51) KMT2APOLBMEN1MAPTALDH1A1
SCHEMBL14831584 0.82 GAA (0.51) KMT2APOLBMEN1L3MBTL1SKP2
SCHEMBL10364380 0.82 MAPT (0.55) KMT2APOLBMEN1MAPTALDH1A1
SCHEMBL6829715 0.81 SKP2 (0.53) KMT2APOLBMEN1MAPTALDH1A1
SCHEMBL21003290 0.81 SKP2 (0.53) KMT2APOLBMEN1MAPTALDH1A1
SCHEMBL11405177 0.80 SKP2 (0.46) KMT2APOLBMEN1SKP2LMNA
SCHEMBL9979434 0.80 PLK1 (0.52) KMT2AMEN1SKP2
SCHEMBL4352883 0.79 EPHX2 (0.56) KMT2APOLBMAPTALDH1A1EPHX2
SCHEMBL13650228 0.78 MAPT (0.53) KMT2APOLBMEN1MAPTALDH1A1

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 KMT2A 2755/4885POLB 4046/4885MEN1 903/4885
US-20100041887-A1 QUINUCLIDINE DERIVATIVES BINDING TO MUCARINIC M3 RECEPTORS CHRM3, CHRM2, CHRM1 KMT2A 2755/4885POLB 4046/4885MEN1 903/4885

“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.