SCHEMBL868158

SCHEMBL868158

CCS(=O)(=O)Nc1ccc(F)c(-n2nnn(CCCF)c2=O)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRAF P15056 19/20 0.41
KCNH2 Q12809 1/20 0.41
PSIP1 O75475 1/20 0.36

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
SCHEMBL29367340 0.80 EGLN1 (0.34) BRAFKCNH2PSIP1
SCHEMBL9730340 0.77 BRPF1 (0.38)
SCHEMBL21381465 0.75 PGR (0.40)
SCHEMBL4364051 0.74 BRAF (0.31) BRAF
SCHEMBL8411916 0.67 PTGES2 (0.34)
SCHEMBL10521129 0.67 CA2 (0.35)
SCHEMBL10521928 0.67 NLRP3 (0.33)
SCHEMBL10521007 0.66
Potassium SCHEMBL10519386 0.66 CA2 (0.34)
SCHEMBL10519375 0.66 CA2 (0.34)

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
CN-104024235-A HERBICIDALLY ACTIVE OXIME-ETHER-SUBSTITUTED BENZOYLAMIDES BAYER IP GMBH 2014-09-03 CN disclosed
CN-104024234-A Tetrazol-5-yl- and triazol-5-yl-aryl compounds and use thereof as herbicides BAYER IP GMBH 2014-09-03 CN disclosed
US-20120077677-A1 Use of 4-phenylbutyric acid and/or salts thereof for enhancing stress tolerance in plants BAYER CROPSCIENCE AG (DE) 2012-03-29 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-20120077677-A1 Use of 4-phenylbutyric acid and/or salts thereof for enhancing stress tolerance in plants PAH, ABAT, HPD BRAF 2869/4885KCNH2 2956/4885PSIP1 935/4885

“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.