SCHEMBL6049451

SCHEMBL6049451

CCCCN(C)S(=O)(=O)NC(=O)c1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 4/20 0.35
SCN9A Q15858 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CRHR1 P34998 1/20 0.32
ALDH1A1 P00352 1/20 0.32
AGTR1 P30556 1/20 0.31
AGTR2 P50052 1/20 0.31

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
SCHEMBL6049391 0.95 SCN9A (0.34) P2RX7SCN9AKDM4ECRHR1ALDH1A1
SCHEMBL6049349 0.91 SCN9A (0.35) P2RX7SCN9AKDM4ECRHR1ALDH1A1
SCHEMBL6049359 0.91 P2RX7 (0.33) P2RX7SCN9ACRHR1ALDH1A1
SCHEMBL6049362 0.88 SCN9A (0.42) SCN9A
SCHEMBL6049386 0.87 SCN9A (0.34) P2RX7SCN9AKDM4ECRHR1
SCHEMBL6049373 0.87 SCN9A (0.36) P2RX7SCN9AKDM4ECRHR1
SCHEMBL6049393 0.86 SCN9A (0.34) SCN9AAGTR1AGTR2
SCHEMBL6049387 0.85 SCN9A (0.33) P2RX7SCN9ACRHR1ALDH1A1
SCHEMBL6049395 0.82 SCN9A (0.34) P2RX7SCN9AKDM4ECRHR1ALDH1A1
SCHEMBL6049420 0.80 SCN9A (0.33) SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458237-B1 HERBICIDAL MIXTURE BASED ON 7-PYRAZOLYLBENZOXAZOLES BASF AG (DE) 2006-04-12 EP claimed
US-20050037923-A1 Herbicidal mixture based on 7-pyrazolybenzoxazoles BASF AKTIENGESELLSCHAFT (DE) 2005-02-17 US claimed
EP-1458237-B1 HERBICIDAL MIXTURE BASED ON 7-PYRAZOLYLBENZOXAZOLES BASF AG (DE) 2006-04-12 EP disclosed
US-20050037923-A1 Herbicidal mixture based on 7-pyrazolybenzoxazoles BASF AKTIENGESELLSCHAFT (DE) 2005-02-17 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-20050037923-A1 Herbicidal mixture based on 7-pyrazolybenzoxazoles DDT, CYP2W1, CYP3A7 P2RX7 5/4885SCN9A 3213/4885KDM4E 3461/4885

“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.