SCHEMBL807620

SCHEMBL807620

O=C(NCc1cnc(N2CCC(c3cc(Cl)c(Cl)c(Cl)c3)(C(F)(F)F)C2O)nc1C(F)(F)F)C1CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
RXFP1 Q9HBX9 3/20 0.34
KCNH2 Q12809 1/20 0.34
MCHR1 Q99705 1/20 0.34
EPHX2 P34913 8/20 0.34
CYP2C9 P11712 4/20 0.34
KDM4E B2RXH2 1/20 0.34
PTGES O14684 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL794326 0.82 RXFP1 (0.36) NR1H2NR1H3RXFP1KCNH2MCHR1
SCHEMBL15467211 0.81 CRHR1 (0.36) RXFP1EPHX2PTGES
SCHEMBL20631667 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL20631225 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL17874617 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL25277402 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL20631666 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL22548984 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL20633240 0.78 AR (0.42) KCNH2MCHR1EPHX2
SCHEMBL29766735 0.78 AR (0.42) KCNH2MCHR1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9375000-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
US-9375000-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
US-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-13 US disclosed
US-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-13 US disclosed
WO-2012035011-A1 PESTICIDAL ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2012-03-22 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 (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-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES DDT, ACHE, CAT NR1H2 2771/4885NR1H3 3129/4885RXFP1 1157/4885

“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.