SCHEMBL3296116

SCHEMBL3296116

Cc1[nH]c(C(=O)NC2CCN(c3nc(C(F)(F)F)ccc3C(N)=O)CC2)cc1Br

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.41
SCN10A Q9Y5Y9 1/20 0.40
PARP1 P09874 1/20 0.39
RPS6KB1 P23443 1/20 0.38
PAK1 Q13153 1/20 0.38

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
SCHEMBL3282647 0.85 TRPV1 (0.40) TRPV1
SCHEMBL3281532 0.82 DRD2 (0.47)
SCHEMBL5218692 0.81 SCN10A (0.42) TRPV1SCN10ARPS6KB1PAK1
SCHEMBL3282668 0.75 TRPV1 (0.52) TRPV1
SCHEMBL3297445 0.73 HRH3 (0.54)
SCHEMBL3288904 0.73 HRH3 (0.43)
SCHEMBL3281503 0.73 GRM4 (0.44)
SCHEMBL3288544 0.73 PTGER4 (0.41)
SCHEMBL3289135 0.73
SCHEMBL3285352 0.73

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-7709503-B2 Pyrrol derivatives with antibacterial activity ASTRAZENECA AB (SE) 2010-05-04 US disclosed
EP-1664025-B1 PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2007-09-19 EP disclosed
US-20060223801-A1 Pyrrol derivatives with antibacterial activity ASTRAZENECA AB (SE) 2006-10-05 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-20060223801-A1 Pyrrol derivatives with antibacterial activity PEF1, PEPD, PELP1 TRPV1 1371/4885SCN10A 3366/4885PARP1 1257/4885

“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.