SCHEMBL83172

SCHEMBL83172

O=C(Nc1ccc(Cl)nc1C1CCN(C/C=C/c2ccc(Cl)cc2)CC1)c1ccnc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.40
PROKR1 Q8TCW9 1/20 0.39
EBP Q15125 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 2/20 0.38
CCR3 P51677 1/20 0.38
DHCR7 Q9UBM7 1/20 0.37
F10 P00742 2/20 0.37

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
SCHEMBL9884600 0.93 MCHR1 (0.42) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL14747949 0.92 MCHR1 (0.40) MCHR1SMN1; SMN2EBPSIGMAR1ALDH1A1
SCHEMBL1420976 0.91 MCHR1 (0.40) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL1420974 0.91 MCHR1 (0.40) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL1420947 0.91 MCHR1 (0.40) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL1420945 0.91 MCHR1 (0.40) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL1463274 0.91 MCHR1 (0.42) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL1463315 0.91 MCHR1 (0.42) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL74213 0.91 MCHR1 (0.45) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1
SCHEMBL74214 0.91 MCHR1 (0.45) MCHR1SMN1; SMN2PROKR1EBPSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045422-B2 Piperidine derivatives with pesticidal properties SYNGENTA PARTICIPATIONS AG (CH) 2015-06-02 US disclosed
US-9045422-B2 Piperidine derivatives with pesticidal properties SYNGENTA PARTICIPATIONS AG (CH) 2015-06-02 US disclosed
US-20130310399-A1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-21 US disclosed
US-8546569-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-10-01 US disclosed
US-8546569-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-10-01 US disclosed
US-20120270885-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-10-25 US disclosed
US-20120270885-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-10-25 US disclosed
US-8193362-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2012-06-05 US disclosed
US-8193362-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2012-06-05 US disclosed
US-8129534-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2012-03-06 US disclosed
US-8129534-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2012-03-06 US disclosed
EP-2297136-B1 INSECTICIDAL PYRIDYLPIPERIDINE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2011-12-28 EP disclosed
US-20110071191-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-03-24 US disclosed
US-20110071191-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-03-24 US disclosed
WO-2009138219-A2 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-11-19 WO disclosed
US-20090042938-A1 Chemical Compounds SYNGENTA CROP PROTECTION, INC. (US) 2009-02-12 US disclosed
US-20090042938-A1 Chemical Compounds SYNGENTA CROP PROTECTION, INC. (US) 2009-02-12 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 (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-20120270885-A1 CHEMICAL COMPOUNDS H1-0, CHRM1, MRM1 MCHR1 455/4885SMN1; SMN2 1932/4885PROKR1 2895/4885
US-20090042938-A1 Chemical Compounds CHRM1, MRM1, H1-0 MCHR1 439/4885SMN1; SMN2 1351/4885PROKR1 2813/4885
US-20110071191-A1 INSECTICIDAL COMPOUNDS CBR3, CBR1, ACHE MCHR1 351/4885SMN1; SMN2 3415/4885PROKR1 548/4885
US-20130310399-A1 CHEMICAL COMPOUNDS ACHE, CHRM1, CHRM2 MCHR1 391/4885SMN1; SMN2 1134/4885PROKR1 3568/4885

“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.