SCHEMBL5440460

SCHEMBL5440460

Cn1cc(CNC(=O)c2cc3ccccc3n(-c3cccc(C(F)(F)F)c3)c2=O)cn1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.54
CCR1 P32246 11/20 0.51
PLA2G10 O15496 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
DDT P30046 1/20 0.43

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
SCHEMBL5438320 0.90 CCR1 (0.53) ELANECCR1PLA2G10DDT
SCHEMBL5440126 0.88 DDT (0.51) ELANECCR1PLA2G10DDT
SCHEMBL5757244 0.85 ELANE (0.67) ELANECCR1ALDH1A1MAPTDDT
SCHEMBL5445075 0.84 ELANE (0.52) ELANECCR1PLA2G10
SCHEMBL5438329 0.84 ELANE (0.59) ELANECCR1PLA2G10ALDH1A1MAPT
SCHEMBL5443539 0.84 SORT1 (0.56) ELANECCR1PLA2G10ALDH1A1
SCHEMBL31490289 0.84 ELANE (0.60) ELANECCR1ALDH1A1MAPTRXFP1
SCHEMBL561082 0.84 ELANE (0.60) ELANECCR1ALDH1A1MAPTRXFP1
SCHEMBL5440472 0.84 DDT (0.56) ELANECCR1PLA2G10ALDH1A1DDT
SCHEMBL5445052 0.83 ELANE (0.46) ELANECCR1PLA2G10ALDH1A1DDT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010551-A1 Quinoline derivatives as neutrophil elastase inhibitors and their use ASTRAZENECA AB (SE) 2007-01-11 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-20070010551-A1 Quinoline derivatives as neutrophil elastase inhibitors and their use SERPINB1, ELANE, MPO ELANE 2/4885CCR1 200/4885PLA2G10 1148/4885

“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.