SCHEMBL797804

SCHEMBL797804

O=C(NCc1ccc(N2CCC(c3cc(Cl)c(Cl)c(Cl)c3)(C(F)(F)F)C2)cc1C(F)(F)F)C1CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.44
NOTUM Q6P988 3/20 0.42
CYP2C9 P11712 2/20 0.41
KCNH2 Q12809 1/20 0.41
MCHR1 Q99705 1/20 0.41
AR P10275 1/20 0.40

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
SCHEMBL798235 0.92 EPHX2 (0.45) EPHX2NOTUMCYP2C9KCNH2MCHR1
SCHEMBL794397 0.92 KCNH2 (0.44) EPHX2KCNH2MCHR1
SCHEMBL15467187 0.91 EPHX2 (0.45) EPHX2CYP2C9KCNH2MCHR1AR
SCHEMBL18229242 0.90 AR (0.42) EPHX2KCNH2MCHR1AR
SCHEMBL18227011 0.90 AR (0.42) EPHX2KCNH2MCHR1AR
SCHEMBL794609 0.90 EPHX2 (0.40) EPHX2NOTUMKCNH2MCHR1
SCHEMBL12467240 0.89 FAAH (0.40) EPHX2NOTUM
SCHEMBL792802 0.89 EPHX2 (0.39) EPHX2NOTUM
SCHEMBL15467164 0.89 EPHX2 (0.40) EPHX2NOTUM
SCHEMBL15466705 0.87 KCNH2 (0.48) EPHX2KCNH2MCHR1

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 3 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
CN-103282347-B Pesticidal arylpyrrolidines BAYER IP GMBH 2015-04-01 CN disclosed
US-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-13 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 (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 EPHX2 1332/4885NOTUM 311/4885CYP2C9 81/4885

“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.