SCHEMBL1201389

SCHEMBL1201389

Cc1nc(Oc2ccc(Cl)c(C(F)(F)F)c2)c(C#N)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 8/20 0.49
CYP1A2 P05177 3/20 0.45
CYP2C9 P11712 3/20 0.45
CYP2C19 P33261 3/20 0.45
RECQL P46063 1/20 0.45
AR P10275 8/20 0.43
HPGD P15428 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 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
SCHEMBL1202006 0.87 PLA2G7 (0.39) PLA2G7CYP1A2CYP2C9CYP2C19RECQL
SCHEMBL1200388 0.85 SCN9A (0.39) PLA2G7
SCHEMBL16976177 0.85 AR (0.48) PLA2G7CYP1A2CYP2C9CYP2C19RECQL
SCHEMBL12878795 0.84 PLA2G7 (0.38) PLA2G7
SCHEMBL14135770 0.83 CCR2 (0.40) PLA2G7AR
SCHEMBL1201382 0.81 CHEK2 (0.38) PLA2G7CYP1A2CYP2C19ARHPGD
SCHEMBL1201908 0.76 PIN1 (0.44) PLA2G7
SCHEMBL1201929 0.74 PIN1 (0.42) PLA2G7
SCHEMBL12878958 0.73 PLA2G7 (0.38) PLA2G7CYP1A2CYP2C9CYP2C19RECQL
SCHEMBL6488771 0.72 TDP1 (0.47) PLA2G7AR

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-9096525-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION, LLC (US) 2015-08-04 US disclosed
US-9096525-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION, LLC (US) 2015-08-04 US disclosed
US-20130338105-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA CROP PROTECTION LLC (US) 2013-12-19 US disclosed
US-8513286-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION LLC (US) 2013-08-20 US disclosed
US-20110046088-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-02-24 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-20110046088-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES CD14, MYADM, MPO PLA2G7 1795/4885CYP1A2 194/4885CYP2C9 168/4885
US-20130338105-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES CD14, MYADM, MPO PLA2G7 1755/4885CYP1A2 150/4885CYP2C9 130/4885

“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.